A0A3Q0KSV2_SCHMA Loading...

GCV_T domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KSV2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 396 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	27.1	Very low	29.6	Very low	224 Å²	224	140.9 Å²	140.9	100%	1.103	78%	0.778	S	S	*	*				0	105.4	0	-177.9	178.4	179.2	0	0	108.2
2	I	29.7	Very low	30.3	Very low	140 Å²	140	143.3 Å²	143.3	72%	0.718	78%	0.778	S	S	*	*			trans	-137.6	114.1	154.6	-59.9	-179.4	0	0	0	104.6	F4	I2-F4 HydrophobicContact CB-CE2 4.5Å; I2-F4 HydrophobicContact CG2-CD2 3.67Å; I2-F4 HydrophobicContact CG2-CE2 3.33Å; I2-F4 HydrophobicContact CG2-CG 4.46Å; I2-F4 HydrophobicContact CG2-CZ 3.88Å
3	V	23.8	Very low	30.7	Very low	125 Å²	125	143.9 Å²	143.9	76%	0.758	77%	0.769	S	S	*	*			trans	-98.7	113.7	174.8	175.9	0	0	0	0	106	G5	V3-G5 PolarHBondContact O-N 3.36Å
4	F	32.3	Very low	31.7	Very low	171 Å²	171	142.6 Å²	142.6	75%	0.75	77%	0.769	S	S	*	*			trans	-93.6	94.7	170	-80.6	-75.9	0	0	0	109.5	I2	I2-F4 HydrophobicContact CB-CE2 4.5Å; I2-F4 HydrophobicContact CG2-CD2 3.67Å; I2-F4 HydrophobicContact CG2-CE2 3.33Å; I2-F4 HydrophobicContact CG2-CG 4.46Å; I2-F4 HydrophobicContact CG2-CZ 3.88Å
5	G	25.9	Very low	33	Very low	57 Å²	57	143.5 Å²	143.5	59%	0.588	76%	0.764	S	S	*	*			trans	-117.5	96	156	0	0	0	0	0	107.2	V3	V3-G5 PolarHBondContact O-N 3.36Å
6	N	27.8	Very low	34.5	Very low	152 Å²	152	141.5 Å²	141.5	81%	0.813	76%	0.761	S	S	*	*			trans	-178.4	123.9	138.4	-90.9	-24.4	0	0	0	109.7	L8	N6-L8 VanDerWaalsContact C-N 3.26Å; N6-L8 PolarHBondContact O-N 2.78Å
7	S	29	Very low	36.5	Very low	122 Å²	122	141.1 Å²	141.1	85%	0.853	75%	0.751	S	S	*	*			trans	-53.7	84.9	164.9	168.3	0	0	0	0	110.1
8	L	30.4	Very low	38.6	Very low	159 Å²	159	138.1 Å²	138.1	83%	0.832	73%	0.727	S	S	*	*			trans	-87.1	112.9	159.3	-80.7	163.2	0	0	0	106	N6 A10	N6-L8 VanDerWaalsContact C-N 3.26Å; N6-L8 PolarHBondContact O-N 2.78Å; L8-A10 PolarHBondContact O-N 3.38Å
9	R	29.2	Very low	40.8	Very low	236 Å²	236	134.7 Å²	134.7	89%	0.891	71%	0.71	S	S	*	*			trans	-43.1	112.9	169.7	-77.4	177.8	170.8	177.6	-3.2	108.2	S11	R9-S11 VanDerWaalsContact C-N 3.27Å; R9-S11 PolarHBondContact O-N 2.84Å
10	A	37.8	Very low	43.2	Very low	80 Å²	80	128.2 Å²	128.2	66%	0.661	68%	0.675	S	S	*	*			trans	-61	92	175.3	0	0	0	0	0	108.6	L8 H12	L8-A10 PolarHBondContact O-N 3.38Å; A10-H12 PolarHBondContact O-N 3.35Å; A10-H12 PolarHBondContact O-ND1 3.42Å; A10-H12 VanDerWaalsContact O-ND1 3.11Å
11	S	32.9	Very low	45.4	Very low	84 Å²	84	122.8 Å²	122.8	59%	0.587	65%	0.648	S	S	*	*			trans	-49.2	116.9	152.7	49.5	0	0	0	0	105.4	R9 F13	R9-S11 VanDerWaalsContact C-N 3.27Å; R9-S11 PolarHBondContact O-N 2.84Å; S11-F13 PolarHBondContact O-N 3.1Å
12	H	37.2	Very low	48.6	Very low	169 Å²	169	112.6 Å²	112.6	78%	0.782	60%	0.598	S	S	*	*			trans	-65.9	72.1	179	-75.3	42.5	0	0	0	109.2	A10 T14	A10-H12 PolarHBondContact O-N 3.35Å; A10-H12 PolarHBondContact O-ND1 3.42Å; A10-H12 VanDerWaalsContact O-ND1 3.11Å; H12-T14 PolarHBondContact O-N 2.97Å
13	F	36.4	Very low	51.7	Low	152 Å²	152	107.2 Å²	107.2	67%	0.667	57%	0.573	S	S	*	*			trans	-68.5	94.7	154.1	-81.4	-81.7	0	0	0	104.9	S11 F15	S11-F13 PolarHBondContact O-N 3.1Å; F13-F15 HydrophobicContact CB-CD2 4.12Å; F13-F15 HydrophobicContact CB-CE2 3.85Å; F13-F15 PolarHBondContact O-N 3.04Å
14	T	44.6	Very low	55.1	Low	125 Å²	125	102.9 Å²	102.9	77%	0.767	54%	0.544	S	S	*	.			trans	-66.4	82.2	165.7	51	0	0	0	0	106.8	H12	H12-T14 PolarHBondContact O-N 2.97Å
15	F	50.2	Low	58.1	Low	156 Å²	156	95 Å²	95	68%	0.684	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-57.2	136.3	162.7	-74.3	-82.1	0	0	0	107.2	F13 K17	F13-F15 HydrophobicContact CB-CD2 4.12Å; F13-F15 HydrophobicContact CB-CE2 3.85Å; F13-F15 PolarHBondContact O-N 3.04Å; F15-K17 PolarHBondContact O-N 2.98Å
16	P	58.4	Low	61.4	Low	112 Å²	112	100.3 Å²	100.3	73%	0.727	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-54	128.7	171.2	22	-30.8	0	0	0	108.2	R18	P16-R18 PolarHBondContact O-N 3.42Å; P16-R18 VanDerWaalsContact O-N 3.13Å
17	K	67.2	Low	64.6	Low	134 Å²	134	97.3 Å²	97.3	58%	0.583	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-54.2	122.1	179.2	-69.4	-166.6	179.7	-161.2	0	108.9	F15 P188 N191	F15-K17 PolarHBondContact O-N 2.98Å; K17-P188 WeakPolarHBondContact CE-O 3.26Å; K17-P188 PolarHBondContact NZ-O 2.92Å; K17-N191 HydrophobicContact CB-CB 4.35Å
18	R	74.2	Confident	67.9	Low	87 Å²	87	92.3 Å²	92.3	33%	0.328	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	144	-177.7	-67.1	-175.1	-172.5	-172.4	9.1	110.2	P16 C190 N191	P16-R18 PolarHBondContact O-N 3.42Å; P16-R18 VanDerWaalsContact O-N 3.13Å; R18-C190 CarbonylContact O-C 3.53Å; R18-C190 VanDerWaalsContact O-CA 3.26Å; R18-C190 WeakPolarHBondContact O-CA 3.28Å; R18-C190 WeakPolarHBondContact O-CB 3.41Å; R18-N191 PolarHBondContact O-N 2.88Å
19	L	81.8	Confident	71	Confident	75 Å²	75	86.3 Å²	86.3	39%	0.393	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	126.1	177.8	-74.5	165	0	0	0	110.1	T131 N191	L19-T131 HydrophobicContact CB-CG2 3.67Å; L19-T131 WeakPolarHBondContact CB-OG1 3.21Å; L19-N191 WeakPolarHBondContact CA-O 3.4Å; L19-N191 HydrophobicContact CD2-CB 3.9Å; L19-N191 WeakPolarHBondContact CD2-ND2 3.4Å
20	L	87.6	Confident	74.2	Confident	3 Å²	3	75.1 Å²	75.1	2%	0.016	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	123.7	-178.9	-172.1	67.8	0	0	0	109.1	I22 A128 L138 W144 F187 C190 N191 T192 K193	L20-I22 HydrophobicContact CD2-CD1 3.83Å; L20-I22 HydrophobicContact CD2-CG1 4.07Å; L20-I22 HydrophobicContact CG-CD1 4.29Å; L20-I22 HydrophobicContact CG-CG1 4Å; L20-A128 HydrophobicContact CD1-CB 3.91Å; L20-A128 HydrophobicContact CD2-CB 4.36Å; L20-A128 HydrophobicContact CG-CB 4.23Å; L20-L138 HydrophobicContact CD1-CD2 3.65Å; L20-W144 HydrophobicContact CD1-CE3 4.32Å; L20-W144 HydrophobicContact CD2-CB 4.3Å; L20-W144 HydrophobicContact CD2-CE3 4.05Å; L20-F187 HydrophobicContact CD2-CB 4.49Å; L20-F187 HydrophobicContact CD2-CG 4.39Å; L20-C190 HydrophobicContact CB-CB 3.91Å; L20-C190 HydrophobicContact CD2-CB 4.31Å; L20-N191 PolarHBondContact N-O 3.48Å; L20-T192 HydrophobicContact CB-CG2 4.48Å; L20-T192 CarbonylContact O-C 3.35Å; L20-T192 WeakPolarHBondContact O-CA 3.22Å; L20-K193 PolarHBondContact O-N 3.48Å
21	S	90.4	Very high	77.1	Confident	16 Å²	16	71.3 Å²	71.3	11%	0.112	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.6	173.7	-73.6	0	0	0	0	109.9	A128 M129 T131 K193	S21-A128 CarbonylContact O-C 3.59Å; S21-A128 VanDerWaalsContact O-CA 3.29Å; S21-A128 WeakPolarHBondContact O-CA 3.46Å; S21-M129 PolarHBondContact N-O 2.99Å; S21-M129 PolarHBondContact O-N 3.31Å; S21-T131 VanDerWaalsContact OG-CG2 3.31Å; S21-T131 WeakPolarHBondContact OG-CG2 3.24Å; S21-K193 CarbonylContact C-O 3.56Å; S21-K193 VanDerWaalsContact CA-O 3.27Å; S21-K193 WeakPolarHBondContact CA-O 3.23Å
22	I	93.1	Very high	80.1	Confident	9 Å²	9	67.8 Å²	67.8	5%	0.046	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	138.2	-175.7	-55.7	176.6	0	0	0	110.1	L20 W126 V127 A128 I175 F187 T192 K193 L195	L20-I22 HydrophobicContact CD2-CD1 3.83Å; L20-I22 HydrophobicContact CD2-CG1 4.07Å; L20-I22 HydrophobicContact CG-CD1 4.29Å; L20-I22 HydrophobicContact CG-CG1 4Å; I22-W126 HydrophobicContact CG2-CB 4.45Å; I22-W126 HydrophobicContact CG2-CE3 3.87Å; I22-V127 VanDerWaalsContact CA-O 3.31Å; I22-V127 WeakPolarHBondContact CA-O 3.39Å; I22-A128 HydrophobicContact CG1-CB 4.16Å; I22-I175 HydrophobicContact CD1-CD1 4.23Å; I22-I175 HydrophobicContact CG2-CD1 4.3Å; I22-F187 HydrophobicContact CD1-CD2 3.86Å; I22-F187 HydrophobicContact CD1-CE2 4.3Å; I22-T192 HydrophobicContact CD1-CG2 3.99Å; I22-K193 PolarHBondContact N-O 2.93Å; I22-L195 PolarHBondContact O-N 3.43Å
23	S	94.5	Very high	82.8	Confident	27 Å²	27	59.8 Å²	59.8	19%	0.189	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	150.4	171.2	-176.8	0	0	0	0	112	W126 V127 L195	S23-W126 CarbonylContact O-C 3.59Å; S23-W126 WeakPolarHBondContact O-CA 3.42Å; S23-V127 PolarHBondContact N-O 3.34Å; S23-V127 PolarHBondContact O-N 3.24Å; S23-L195 VanDerWaalsContact CB-O 3.24Å; S23-L195 WeakPolarHBondContact CB-O 3.21Å; S23-L195 PolarHBondContact OG-O 3.4Å
24	Q	95.8	Very high	85.5	Confident	34 Å²	34	54.9 Å²	54.9	16%	0.159	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	133.8	177.2	-168.4	-173	14.9	0	0	109.5	K26 W126 N180	Q24-K26 VanDerWaalsContact C-N 3.3Å; Q24-K26 HydrophobicContact CB-CG 4.35Å; Q24-K26 HydrophobicContact CG-CG 4.27Å; Q24-K26 PolarHBondContact O-N 3.11Å; Q24-W126 VanDerWaalsContact CA-CE3 3.44Å; Q24-W126 HydrophobicContact CB-CD2 3.8Å; Q24-W126 HydrophobicContact CB-CE3 3.66Å; Q24-W126 HydrophobicContact CB-CH2 3.87Å; Q24-W126 HydrophobicContact CB-CZ2 4.03Å; Q24-W126 HydrophobicContact CB-CZ3 3.7Å; Q24-W126 HydrophobicContact CG-CD2 4.08Å; Q24-W126 HydrophobicContact CG-CE3 4.43Å; Q24-W126 HydrophobicContact CG-CH2 4.42Å; Q24-W126 HydrophobicContact CG-CZ2 4.08Å; Q24-N180 PolarHBondContact OE1-O 3.03Å
25	L	96.2	Very high	87.6	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.037	25%	0.245	C	C	.	.			trans	-82.9	76	172.7	-64.7	178.9	0	0	0	109.7	E27 R28 P125 V127 I197 Y200	L25-E27 PolarHBondContact O-N 3.47Å; L25-R28 HydrophobicContact CB-CB 4.11Å; L25-R28 HydrophobicContact CB-CG 4.14Å; L25-R28 PolarHBondContact O-N 3.38Å; L25-P125 HydrophobicContact CB-CB 4.33Å; L25-P125 HydrophobicContact CB-CG 4.19Å; L25-P125 PolarHBondContact N-O 2.79Å; L25-V127 HydrophobicContact CD1-CB 4.26Å; L25-V127 HydrophobicContact CD2-CB 4.08Å; L25-V127 HydrophobicContact CD2-CG1 3.69Å; L25-V127 HydrophobicContact CG-CB 4.17Å; L25-V127 HydrophobicContact CG-CG1 4.16Å; L25-I197 HydrophobicContact CD2-CD1 3.6Å; L25-Y200 HydrophobicContact CD2-CD1 4.14Å; L25-Y200 HydrophobicContact CD2-CE1 3.8Å
26	K	95	Very high	89.4	Confident	168 Å²	168	47.8 Å²	47.8	73%	0.73	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.6	-176.2	-66.6	-178.5	179.8	179.3	0	114.4	Q24 R28	Q24-K26 VanDerWaalsContact C-N 3.3Å; Q24-K26 HydrophobicContact CB-CG 4.35Å; Q24-K26 HydrophobicContact CG-CG 4.27Å; Q24-K26 PolarHBondContact O-N 3.11Å; K26-R28 PolarHBondContact O-N 3.4Å
27	E	95.1	Very high	91	Very high	88 Å²	88	43.5 Å²	43.5	41%	0.411	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	0.9	175.7	-59.1	-166.6	148.7	0	0	112.7	L25 D95 V96 K214	L25-E27 PolarHBondContact O-N 3.47Å; E27-D95 CarbonylContact O-C 3.58Å; E27-D95 WeakPolarHBondContact O-CA 3.11Å; E27-V96 WeakPolarHBondContact O-CG1 3.4Å; E27-V96 PolarHBondContact O-N 2.91Å; E27-K214 IonicContact OE1-NZ 2.88Å; E27-K214 PolarHBondContact OE1-NZ 3.23Å; E27-K214 IonicContact OE2-NZ 3.97Å
28	R	96.9	Very high	92.2	Very high	17 Å²	17	37.1 Å²	37.1	6%	0.064	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	146.3	179.6	-53.6	-155.2	84.5	87.9	-8.3	111.2	L25 K26 D74 E93 V94 P125 E211	L25-R28 HydrophobicContact CB-CB 4.11Å; L25-R28 HydrophobicContact CB-CG 4.14Å; L25-R28 PolarHBondContact O-N 3.38Å; K26-R28 PolarHBondContact O-N 3.4Å; R28-D74 IonicContact CZ-OD2 3.49Å; R28-D74 IonicContact NH2-OD1 3.64Å; R28-D74 PolarHBondContact NH2-OD1 3.22Å; R28-D74 IonicContact NH2-OD2 3.78Å; R28-D74 PolarHBondContact NH2-OD2 3.38Å; R28-D74 VanDerWaalsContact NH2-OD2 3.1Å; R28-E93 HydrophobicContact CB-CG 4.12Å; R28-E93 VanDerWaalsContact CD-OE1 3.31Å; R28-E93 WeakPolarHBondContact CD-OE1 3.29Å; R28-E93 IonicContact NE-OE1 2.87Å; R28-V94 CarbonylContact C-O 3.5Å; R28-V94 VanDerWaalsContact CA-O 3.22Å; R28-V94 WeakPolarHBondContact CA-O 3.46Å; R28-V94 WeakPolarHBondContact CB-O 3.35Å; R28-P125 HydrophobicContact CB-CG 3.85Å; R28-P125 WeakPolarHBondContact O-CG 3.37Å; R28-E211 IonicContact NH1-OE1 3.89Å
29	S	96.8	Very high	93.1	Very high	34 Å²	34	36.3 Å²	36.3	24%	0.238	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	167.6	179.2	-172.1	0	0	0	0	110.1	E93 V94	S29-E93 WeakPolarHBondContact O-CA 3.42Å; S29-V94 PolarHBondContact N-O 3.15Å; S29-V94 PolarHBondContact O-N 3.03Å
30	L	97	Very high	93.6	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.2	-175.4	-67.1	151	0	0	0	110.8	Y78 L91 V92 E93 L121 V123 L176	L30-Y78 HydrophobicContact CD2-CD2 4.35Å; L30-Y78 HydrophobicContact CD2-CE2 4.27Å; L30-L91 HydrophobicContact CD2-CB 3.91Å; L30-V92 CarbonylContact C-O 3.6Å; L30-V92 WeakPolarHBondContact CA-O 3.39Å; L30-E93 HydrophobicContact CD2-CB 3.69Å; L30-E93 HydrophobicContact CD2-CG 4.5Å; L30-L121 HydrophobicContact CB-CD1 3.95Å; L30-V123 HydrophobicContact CD1-CB 3.6Å; L30-V123 HydrophobicContact CD1-CG1 3.3Å; L30-L176 HydrophobicContact CD1-CD1 4.44Å; L30-L176 HydrophobicContact CD1-CD2 4.08Å; L30-L176 HydrophobicContact CD2-CD1 4.22Å; L30-L176 HydrophobicContact CD2-CD2 4.24Å
31	I	97.5	Very high	94	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	128.9	166.5	-59.2	161.5	0	0	0	107.4	L91 V92 V94 V99 L102 V103 L106 I117 D118 A119	I31-L91 CarbonylContact O-C 3.46Å; I31-L91 WeakPolarHBondContact O-CA 3.46Å; I31-V92 HydrophobicContact CB-CB 4.34Å; I31-V92 PolarHBondContact N-O 3.39Å; I31-V92 PolarHBondContact O-N 3.21Å; I31-V94 HydrophobicContact CD1-CG2 4.32Å; I31-V99 HydrophobicContact CD1-CG1 4.26Å; I31-V99 HydrophobicContact CG1-CG1 4.21Å; I31-L102 HydrophobicContact CD1-CB 4.14Å; I31-L102 HydrophobicContact CD1-CD2 3.78Å; I31-L102 HydrophobicContact CD1-CG 3.99Å; I31-V103 HydrophobicContact CD1-CG2 3.8Å; I31-V103 HydrophobicContact CG1-CG2 4.14Å; I31-V103 HydrophobicContact CG2-CG2 4.4Å; I31-L106 HydrophobicContact CG2-CD1 4.16Å; I31-I117 HydrophobicContact CG2-CG2 3.72Å; I31-D118 CarbonylContact C-O 3.58Å; I31-D118 WeakPolarHBondContact CA-O 3.48Å; I31-A119 HydrophobicContact CG1-CB 4.13Å
32	C	95.7	Very high	94.3	Very high	10 Å²	10	39.2 Å²	39.2	7%	0.068	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	126.7	174.1	-176.4	0	0	0	0	109.3	Y90 L91 I117 D118 L121	C32-Y90 WeakPolarHBondContact CA-O 3.5Å; C32-L91 HydrophobicContact CB-CD2 3.85Å; C32-I117 WeakPolarHBondContact O-CA 3.19Å; C32-D118 HydrophobicContact CB-CB 4.33Å; C32-D118 PolarHBondContact N-O 2.86Å; C32-D118 PolarHBondContact O-N 2.76Å; C32-L121 HydrophobicContact CB-CD1 3.68Å; C32-L121 HydrophobicContact CB-CD2 3.89Å; C32-L121 HydrophobicContact CB-CG 4.33Å
33	V	95.3	Very high	94.5	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	108.6	170.2	-176.3	0	0	0	0	107.3	A38 F41 L42 Y90 V92 L106 V115	V33-A38 HydrophobicContact CG1-CB 4.04Å; V33-F41 HydrophobicContact CG1-CD1 3.88Å; V33-F41 HydrophobicContact CG1-CE1 4.18Å; V33-L42 HydrophobicContact CB-CD1 4.34Å; V33-L42 HydrophobicContact CG1-CD1 4.48Å; V33-L42 HydrophobicContact CG1-CG 4.33Å; V33-L42 HydrophobicContact CG2-CD2 4.28Å; V33-Y90 PolarHBondContact N-O 3.39Å; V33-Y90 PolarHBondContact O-N 3.03Å; V33-Y90 VanDerWaalsContact O-N 3.16Å; V33-V92 HydrophobicContact CG2-CG2 4.19Å; V33-L106 HydrophobicContact CG2-CD1 4.23Å; V33-V115 HydrophobicContact CG1-CB 4.22Å; V33-V115 HydrophobicContact CG1-CG2 4.24Å
34	H	91.1	Very high	94.6	Very high	49 Å²	49	40.1 Å²	40.1	23%	0.227	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	146.3	-170.9	175.5	79.7	0	0	0	111.3	S84 Q87 D89 V115 K116	H34-S84 PolarHBondContact CE1-OG 2.62Å; H34-Q87 PolarHBondContact CE1-OE1 3.32Å; H34-Q87 PolarHBondContact NE2-OE1 3.04Å; H34-D89 IonicContact CE1-OD1 2.94Å; H34-D89 IonicContact CG-OD1 3.96Å; H34-D89 IonicContact ND1-OD1 3.58Å; H34-D89 PolarHBondContact ND1-OD1 3.41Å; H34-V115 CarbonylContact O-C 3.48Å; H34-V115 VanDerWaalsContact O-CA 3.24Å; H34-V115 WeakPolarHBondContact O-CA 3.38Å; H34-V115 WeakPolarHBondContact O-CB 3.36Å; H34-K116 HydrophobicContact CB-CB 4.39Å; H34-K116 PolarHBondContact N-O 3.31Å; H34-K116 PolarHBondContact O-N 2.8Å
35	G	88.7	Confident	94.8	Very high	12 Å²	12	38.8 Å²	38.8	12%	0.124	21%	0.207	C	C	.	.	S	Bend	trans	128.6	162.5	175	0	0	0	0	0	112.8	S37 A38	G35-S37 PolarHBondContact O-N 3.06Å; G35-S37 VanDerWaalsContact O-N 3.1Å; G35-A38 VanDerWaalsContact O-CB 3.23Å; G35-A38 WeakPolarHBondContact O-CB 3.39Å; G35-A38 PolarHBondContact O-N 3.15Å
36	T	88.3	Confident	94.9	Very high	121 Å²	121	38.5 Å²	38.5	74%	0.742	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-13.1	-173.7	54	0	0	0	0	114.9
37	S	91.7	Very high	95	Very high	22 Å²	22	30.5 Å²	30.5	15%	0.154	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.7	16.9	174.8	-53	0	0	0	0	113	G35 D39 E40 F41	G35-S37 PolarHBondContact O-N 3.06Å; G35-S37 VanDerWaalsContact O-N 3.1Å; S37-D39 VanDerWaalsContact C-N 3.3Å; S37-D39 PolarHBondContact O-N 3.49Å; S37-E40 PolarHBondContact O-N 2.58Å; S37-F41 WeakPolarHBondContact O-CB 3.12Å; S37-F41 PolarHBondContact O-N 2.67Å
38	A	93	Very high	95.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-36	-177.6	0	0	0	0	0	112.9	V33 G35 L42 Y90 V115	V33-A38 HydrophobicContact CG1-CB 4.04Å; G35-A38 VanDerWaalsContact O-CB 3.23Å; G35-A38 WeakPolarHBondContact O-CB 3.39Å; G35-A38 PolarHBondContact O-N 3.15Å; A38-L42 WeakPolarHBondContact O-CB 3.39Å; A38-L42 WeakPolarHBondContact O-CG 3.48Å; A38-L42 PolarHBondContact O-N 2.98Å; A38-Y90 HydrophobicContact CB-CD2 3.72Å; A38-Y90 HydrophobicContact CB-CE2 4.1Å; A38-V115 HydrophobicContact CB-CG1 4.23Å
39	D	92.8	Very high	95.2	Very high	70 Å²	70	27.8 Å²	27.8	37%	0.374	16%	0.16	S	C	.	.	H	α-helix	trans	-65.2	-52.3	174.8	65.3	-40.7	0	0	0	111.6	S37 F41 L42 Q43 I50 Y90	S37-D39 VanDerWaalsContact C-N 3.3Å; S37-D39 PolarHBondContact O-N 3.49Å; D39-F41 VanDerWaalsContact C-N 3.28Å; D39-F41 PolarHBondContact O-N 3.2Å; D39-L42 PolarHBondContact O-N 3.26Å; D39-Q43 WeakPolarHBondContact O-CB 3.24Å; D39-Q43 PolarHBondContact O-N 3.33Å; D39-I50 HydrophobicContact CB-CG2 4.33Å; D39-Y90 HydrophobicContact CB-CE2 3.89Å; D39-Y90 WeakPolarHBondContact CB-OH 3.49Å
40	E	93.5	Very high	95.2	Very high	125 Å²	125	26.3 Å²	26.3	58%	0.584	15%	0.149	S	C	*	.	H	α-helix	trans	-58.5	-42.4	177.2	-172.6	-169.9	178.5	0	0	111	S37 Q43 G44	S37-E40 PolarHBondContact O-N 2.58Å; E40-Q43 PolarHBondContact O-N 3.41Å; E40-G44 PolarHBondContact O-N 3.35Å
41	F	96.1	Very high	95	Very high	30 Å²	30	33 Å²	33	13%	0.132	18%	0.178	C	C	.	.	H	α-helix	trans	-64.2	-51.5	178.9	174.1	-108.6	0	0	0	112.4	V33 S37 D39 Q43 G44 L45 L106 N110 V115	V33-F41 HydrophobicContact CG1-CD1 3.88Å; V33-F41 HydrophobicContact CG1-CE1 4.18Å; S37-F41 WeakPolarHBondContact O-CB 3.12Å; S37-F41 PolarHBondContact O-N 2.67Å; D39-F41 VanDerWaalsContact C-N 3.28Å; D39-F41 PolarHBondContact O-N 3.2Å; F41-Q43 VanDerWaalsContact C-N 3.31Å; F41-Q43 PolarHBondContact O-N 3.12Å; F41-G44 PolarHBondContact O-N 3.03Å; F41-L45 HydrophobicContact CD1-CD1 4.44Å; F41-L45 HydrophobicContact CD2-CD1 4.29Å; F41-L45 HydrophobicContact CE1-CD1 3.86Å; F41-L45 HydrophobicContact CE2-CD1 3.66Å; F41-L45 HydrophobicContact CZ-CD1 3.42Å; F41-L45 VanDerWaalsContact CZ-CD1 3.42Å; F41-L106 HydrophobicContact CE1-CB 4.44Å; F41-L106 HydrophobicContact CE1-CD2 3.98Å; F41-L106 HydrophobicContact CZ-CB 4.24Å; F41-L106 HydrophobicContact CZ-CD2 4.2Å; F41-L106 WeakPolarHBondContact CZ-O 3.23Å; F41-N110 HydrophobicContact CE2-CB 3.9Å; F41-N110 HydrophobicContact CZ-CB 4.07Å; F41-V115 HydrophobicContact CB-CG1 4.05Å; F41-V115 HydrophobicContact CD1-CG1 4.39Å; F41-V115 HydrophobicContact CD1-CG2 3.71Å; F41-V115 HydrophobicContact CD2-CG2 4.4Å; F41-V115 HydrophobicContact CE1-CG2 3.86Å; F41-V115 HydrophobicContact CG-CG1 4.3Å; F41-V115 HydrophobicContact CG-CG2 3.98Å; F41-V115 HydrophobicContact CZ-CG2 4.28Å
42	L	97	Very high	94.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-37.2	177.6	-74.3	175.9	0	0	0	111.3	V33 A38 D39 G44 L45 I46 I50 F64 I77 Y90	V33-L42 HydrophobicContact CB-CD1 4.34Å; V33-L42 HydrophobicContact CG1-CD1 4.48Å; V33-L42 HydrophobicContact CG1-CG 4.33Å; V33-L42 HydrophobicContact CG2-CD2 4.28Å; A38-L42 WeakPolarHBondContact O-CB 3.39Å; A38-L42 WeakPolarHBondContact O-CG 3.48Å; A38-L42 PolarHBondContact O-N 2.98Å; D39-L42 PolarHBondContact O-N 3.26Å; L42-G44 PolarHBondContact O-N 3.41Å; L42-G44 VanDerWaalsContact O-N 3.13Å; L42-L45 PolarHBondContact O-N 3.18Å; L42-I46 HydrophobicContact CD2-CG2 4.41Å; L42-I46 WeakPolarHBondContact O-CG1 3.26Å; L42-I46 PolarHBondContact O-N 3.05Å; L42-I50 HydrophobicContact CB-CD1 4.19Å; L42-I50 HydrophobicContact CB-CG1 4.49Å; L42-I50 HydrophobicContact CD1-CD1 4.25Å; L42-F64 HydrophobicContact CD2-CE1 4.42Å; L42-F64 HydrophobicContact CD2-CZ 4.19Å; L42-I77 HydrophobicContact CD1-CG2 4.27Å; L42-Y90 VanDerWaalsContact CD1-CB 3.41Å; L42-Y90 HydrophobicContact CD1-CD1 4.14Å; L42-Y90 HydrophobicContact CD1-CD2 4.02Å; L42-Y90 HydrophobicContact CD1-CG 3.59Å
43	Q	97	Very high	94.7	Very high	26 Å²	26	36.3 Å²	36.3	12%	0.121	20%	0.201	C	C	.	.	H	α-helix	trans	-54.3	-35.6	178.7	-175.2	65.9	-17.6	0	0	112.5	D39 E40 F41 L45 D49 I50 K238	D39-Q43 WeakPolarHBondContact O-CB 3.24Å; D39-Q43 PolarHBondContact O-N 3.33Å; E40-Q43 PolarHBondContact O-N 3.41Å; F41-Q43 VanDerWaalsContact C-N 3.31Å; F41-Q43 PolarHBondContact O-N 3.12Å; Q43-L45 VanDerWaalsContact C-N 3.35Å; Q43-D49 PolarHBondContact NE2-OD1 3.48Å; Q43-D49 PolarHBondContact OE1-OD1 2.61Å; Q43-I50 HydrophobicContact CB-CG2 3.81Å; Q43-I50 HydrophobicContact CG-CG2 4.3Å; Q43-K238 WeakPolarHBondContact O-CE 3.44Å; Q43-K238 PolarHBondContact O-NZ 2.85Å
44	G	97.2	Very high	94.1	Very high	29 Å²	29	41.3 Å²	41.3	30%	0.299	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.9	177	0	0	0	0	0	115.5	E40 F41 L42 Y241 I242	E40-G44 PolarHBondContact O-N 3.35Å; F41-G44 PolarHBondContact O-N 3.03Å; L42-G44 PolarHBondContact O-N 3.41Å; L42-G44 VanDerWaalsContact O-N 3.13Å; G44-Y241 CarbonylContact O-C 3.45Å; G44-Y241 WeakPolarHBondContact O-CA 3.42Å; G44-Y241 WeakPolarHBondContact O-CB 3.48Å; G44-I242 PolarHBondContact O-N 2.84Å
45	L	98.1	Very high	93.6	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.031	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.9	-30.5	-172.2	-64.2	-178.6	0	0	0	114.3	F41 L42 Q43 F64 L106 Y109 I242	F41-L45 HydrophobicContact CD1-CD1 4.44Å; F41-L45 HydrophobicContact CD2-CD1 4.29Å; F41-L45 HydrophobicContact CE1-CD1 3.86Å; F41-L45 HydrophobicContact CE2-CD1 3.66Å; F41-L45 HydrophobicContact CZ-CD1 3.42Å; F41-L45 VanDerWaalsContact CZ-CD1 3.42Å; L42-L45 PolarHBondContact O-N 3.18Å; Q43-L45 VanDerWaalsContact C-N 3.35Å; L45-F64 HydrophobicContact CB-CD1 4.22Å; L45-F64 HydrophobicContact CB-CE1 4.01Å; L45-L106 HydrophobicContact CD1-CD2 3.78Å; L45-Y109 HydrophobicContact CD2-CD1 4.28Å; L45-Y109 HydrophobicContact CD2-CD2 3.69Å; L45-Y109 HydrophobicContact CD2-CE2 4.35Å; L45-Y109 HydrophobicContact CD2-CG 3.68Å; L45-I242 HydrophobicContact CD2-CB 4.4Å; L45-I242 HydrophobicContact CD2-CG2 3.96Å
46	I	98.5	Very high	92.7	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-91.7	151.5	-178.8	69.4	160.5	0	0	0	111.5	L42 N48 I50 M60 S62 L63 F64 I77 K238	L42-I46 HydrophobicContact CD2-CG2 4.41Å; L42-I46 WeakPolarHBondContact O-CG1 3.26Å; L42-I46 PolarHBondContact O-N 3.05Å; I46-N48 VanDerWaalsContact C-N 3.32Å; I46-N48 VanDerWaalsContact CD1-O 3.25Å; I46-N48 WeakPolarHBondContact CD1-O 3.26Å; I46-N48 VanDerWaalsContact CG1-O 3.26Å; I46-N48 WeakPolarHBondContact CG1-O 3.45Å; I46-N48 PolarHBondContact O-N 2.93Å; I46-I50 HydrophobicContact CD1-CB 4.44Å; I46-I50 HydrophobicContact CD1-CD1 3.91Å; I46-M60 HydrophobicContact CD1-SD 3.71Å; I46-S62 WeakPolarHBondContact CB-OG 3.38Å; I46-L63 WeakPolarHBondContact CA-O 3.4Å; I46-F64 HydrophobicContact CG2-CD1 4.19Å; I46-F64 HydrophobicContact CG2-CE1 3.54Å; I46-F64 HydrophobicContact CG2-CE2 3.95Å; I46-F64 HydrophobicContact CG2-CZ 3.41Å; I46-F64 VanDerWaalsContact CG2-CZ 3.41Å; I46-I77 HydrophobicContact CD1-CG1 4.3Å; I46-I77 HydrophobicContact CG2-CD1 4.32Å; I46-K238 PolarHBondContact O-NZ 3.42Å
47	T	98.5	Very high	92.2	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	S	Bend	trans	-73.8	-18.3	176.9	51.6	0	0	0	0	114.5	S62 L63 L65 G233 S235 K238 Y241	T47-S62 PolarHBondContact N-OG 2.9Å; T47-S62 PolarHBondContact OG1-OG 2.8Å; T47-L63 HydrophobicContact CG2-CB 3.92Å; T47-L63 PolarHBondContact N-O 2.94Å; T47-L63 PolarHBondContact OG1-N 3.05Å; T47-L63 PolarHBondContact OG1-O 3.49Å; T47-L65 HydrophobicContact CG2-CD1 3.72Å; T47-L65 HydrophobicContact CG2-CD2 3.95Å; T47-L65 HydrophobicContact CG2-CG 3.65Å; T47-G233 WeakPolarHBondContact CB-O 3.3Å; T47-G233 PolarHBondContact OG1-O 3.05Å; T47-S235 PolarHBondContact O-N 2.88Å; T47-K238 WeakPolarHBondContact O-CD 3.16Å; T47-Y241 HydrophobicContact CG2-CD2 4.29Å; T47-Y241 HydrophobicContact CG2-CE2 3.68Å
48	N	98	Very high	92	Very high	19 Å²	19	46.4 Å²	46.4	10%	0.102	25%	0.249	C	C	.	.	S	Bend	trans	-104.9	163.3	-177.7	-157.4	-2.9	0	0	0	113.1	I46 I50 M60 Y61 S62 G232 K238	I46-N48 VanDerWaalsContact C-N 3.32Å; I46-N48 VanDerWaalsContact CD1-O 3.25Å; I46-N48 WeakPolarHBondContact CD1-O 3.26Å; I46-N48 VanDerWaalsContact CG1-O 3.26Å; I46-N48 WeakPolarHBondContact CG1-O 3.45Å; I46-N48 PolarHBondContact O-N 2.93Å; N48-I50 PolarHBondContact O-N 3.15Å; N48-M60 HydrophobicContact CB-SD 3.7Å; N48-Y61 PolarHBondContact ND2-O 3.22Å; N48-S62 WeakPolarHBondContact CB-OG 3.46Å; N48-S62 PolarHBondContact N-OG 2.97Å; N48-G232 PolarHBondContact ND2-O 3.3Å; N48-K238 WeakPolarHBondContact O-CD 3.4Å; N48-K238 WeakPolarHBondContact O-CE 3.47Å; N48-K238 PolarHBondContact O-NZ 3.45Å
49	D	97.5	Very high	92.2	Very high	30 Å²	30	47.5 Å²	47.5	16%	0.16	25%	0.254	C	S	.	.			trans	-84.6	107	-174.2	-169.8	1.7	0	0	0	112.2	Q43 K51 S52 M60 K238	Q43-D49 PolarHBondContact NE2-OD1 3.48Å; Q43-D49 PolarHBondContact OE1-OD1 2.61Å; D49-K51 PolarHBondContact O-N 3.36Å; D49-K51 WeakPolarHBondContact OD1-CB 3.43Å; D49-K51 PolarHBondContact OD1-N 3.44Å; D49-K51 VanDerWaalsContact OD1-N 3.12Å; D49-S52 WeakPolarHBondContact O-CB 3.5Å; D49-S52 PolarHBondContact O-N 3.39Å; D49-S52 PolarHBondContact O-OG 2.69Å; D49-M60 WeakPolarHBondContact O-CE 3.25Å; D49-K238 HydrophobicContact CB-CB 3.94Å
50	I	95.7	Very high	92.4	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.015	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-56.2	-28.6	179.5	-155.1	70.1	0	0	0	112.1	D39 L42 Q43 I46 N48 S52 I53 I77 Y90	D39-I50 HydrophobicContact CB-CG2 4.33Å; L42-I50 HydrophobicContact CB-CD1 4.19Å; L42-I50 HydrophobicContact CB-CG1 4.49Å; L42-I50 HydrophobicContact CD1-CD1 4.25Å; Q43-I50 HydrophobicContact CB-CG2 3.81Å; Q43-I50 HydrophobicContact CG-CG2 4.3Å; I46-I50 HydrophobicContact CD1-CB 4.44Å; I46-I50 HydrophobicContact CD1-CD1 3.91Å; N48-I50 PolarHBondContact O-N 3.15Å; I50-S52 PolarHBondContact O-N 3.36Å; I50-I53 HydrophobicContact CD1-CD1 3.84Å; I50-I53 HydrophobicContact CD1-CG1 4.14Å; I50-I53 HydrophobicContact CG1-CG1 4.42Å; I50-I53 VanDerWaalsContact O-CG1 3.23Å; I50-I53 WeakPolarHBondContact O-CG1 3.02Å; I50-I53 PolarHBondContact O-N 3.16Å; I50-I77 HydrophobicContact CD1-CG2 3.8Å; I50-Y90 HydrophobicContact CD1-CD1 3.91Å; I50-Y90 HydrophobicContact CD1-CE1 3.68Å; I50-Y90 HydrophobicContact CG1-CD1 4.39Å; I50-Y90 HydrophobicContact CG1-CE1 3.71Å
51	K	93.6	Very high	92.6	Very high	141 Å²	141	38.8 Å²	38.8	61%	0.613	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-65.9	-20.4	-178.9	-61.9	-179.3	178.5	-178.3	0	112.6	D49 I53 N54	D49-K51 PolarHBondContact O-N 3.36Å; D49-K51 WeakPolarHBondContact OD1-CB 3.43Å; D49-K51 PolarHBondContact OD1-N 3.44Å; D49-K51 VanDerWaalsContact OD1-N 3.12Å; K51-I53 PolarHBondContact O-N 2.66Å; K51-N54 PolarHBondContact O-N 3.21Å
52	S	93.3	Very high	92.7	Very high	76 Å²	76	37.3 Å²	37.3	53%	0.531	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-71.7	-15.7	175.2	67.7	0	0	0	0	113.4	D49 I50 M60	D49-S52 WeakPolarHBondContact O-CB 3.5Å; D49-S52 PolarHBondContact O-N 3.39Å; D49-S52 PolarHBondContact O-OG 2.69Å; I50-S52 PolarHBondContact O-N 3.36Å; S52-M60 WeakPolarHBondContact OG-CE 3.37Å
53	I	92.8	Very high	92.8	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.021	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-113.8	31.1	175.3	66.7	168.5	0	0	0	112.9	I50 K51 Q55 S58 M60 I77 H79 Y90	I50-I53 HydrophobicContact CD1-CD1 3.84Å; I50-I53 HydrophobicContact CD1-CG1 4.14Å; I50-I53 HydrophobicContact CG1-CG1 4.42Å; I50-I53 VanDerWaalsContact O-CG1 3.23Å; I50-I53 WeakPolarHBondContact O-CG1 3.02Å; I50-I53 PolarHBondContact O-N 3.16Å; K51-I53 PolarHBondContact O-N 2.66Å; I53-Q55 PolarHBondContact O-N 2.71Å; I53-S58 WeakPolarHBondContact CA-OG 3.37Å; I53-S58 WeakPolarHBondContact CB-OG 3.4Å; I53-S58 PolarHBondContact O-OG 2.87Å; I53-S58 VanDerWaalsContact O-OG 3.08Å; I53-M60 HydrophobicContact CB-CE 3.88Å; I53-M60 HydrophobicContact CD1-CE 3.73Å; I53-M60 HydrophobicContact CD1-CG 4.35Å; I53-M60 HydrophobicContact CG1-CE 3.43Å; I53-M60 VanDerWaalsContact CG1-CE 3.43Å; I53-M60 HydrophobicContact CG2-CB 4.06Å; I53-M60 HydrophobicContact CG2-CE 3.36Å; I53-M60 HydrophobicContact CG2-CG 4.43Å; I53-I77 HydrophobicContact CD1-CB 4.21Å; I53-I77 HydrophobicContact CD1-CG2 3.94Å; I53-I77 WeakPolarHBondContact CD1-O 3.27Å; I53-H79 HydrophobicContact CD1-CB 4.23Å; I53-H79 HydrophobicContact CG1-CB 4.39Å; I53-H79 VanDerWaalsContact O-CB 3.24Å; I53-H79 WeakPolarHBondContact O-CB 3.33Å; I53-H79 PolarHBondContact O-ND1 2.93Å; I53-Y90 HydrophobicContact CD1-CD1 4.16Å; I53-Y90 HydrophobicContact CD1-CE1 3.97Å; I53-Y90 HydrophobicContact CG1-CE1 4.24Å
54	N	83.4	Confident	92.8	Very high	105 Å²	105	36.1 Å²	36.1	56%	0.561	20%	0.199	S	C	*	.			trans	-71	-7.3	-179.8	67.9	-4.3	0	0	0	114.4	K51 H79	K51-N54 PolarHBondContact O-N 3.21Å; N54-H79 PolarHBondContact O-CE1 3.36Å
55	Q	80.7	Confident	92.8	Very high	136 Å²	136	34.7 Å²	34.7	64%	0.636	19%	0.185	S	C	*	.	S	Bend	trans	-93.3	133.5	175.4	-64.3	-178.3	4.4	0	0	109.6	I53 S58 H79	I53-Q55 PolarHBondContact O-N 2.71Å; Q55-S58 WeakPolarHBondContact O-CB 3.38Å; Q55-S58 PolarHBondContact O-N 2.76Å; Q55-S58 PolarHBondContact O-OG 3.13Å; Q55-H79 VanDerWaalsContact C-ND1 3.34Å; Q55-H79 PolarHBondContact O-ND1 3.34Å
56	P	71	Confident	92.7	Very high	65 Å²	65	35.9 Å²	35.9	42%	0.422	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	145.5	172.5	-25.4	33.8	0	0	0	112	S58	P56-S58 VanDerWaalsContact C-N 3.32Å
57	N	75.9	Confident	92.6	Very high	83 Å²	83	40.1 Å²	40.1	44%	0.444	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	32.2	-174.7	-49.7	-48	0	0	0	113.9	H79 F160	N57-H79 PolarHBondContact N-O 3.46Å; N57-F160 VanDerWaalsContact C-CE2 3.49Å
58	S	89.3	Confident	92.5	Very high	27 Å²	27	47.8 Å²	47.8	19%	0.189	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	156.3	166	65	0	0	0	0	110.8	I53 Q55 P56 H79	I53-S58 WeakPolarHBondContact CA-OG 3.37Å; I53-S58 WeakPolarHBondContact CB-OG 3.4Å; I53-S58 PolarHBondContact O-OG 2.87Å; I53-S58 VanDerWaalsContact O-OG 3.08Å; Q55-S58 WeakPolarHBondContact O-CB 3.38Å; Q55-S58 PolarHBondContact O-N 2.76Å; Q55-S58 PolarHBondContact O-OG 3.13Å; P56-S58 VanDerWaalsContact C-N 3.32Å; S58-H79 PolarHBondContact O-N 3Å
59	F	95.6	Very high	92.4	Very high	23 Å²	23	46.9 Å²	46.9	10%	0.101	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	161.8	178.8	84.8	-55.7	0	0	0	111	F76 I77 Y78 F160 A162 S163 P165 R174	F59-F76 HydrophobicContact CD2-CB 4.32Å; F59-F76 AromaticContact CD2-CD1 3.78Å; F59-F76 HydrophobicContact CD2-CD1 3.78Å; F59-F76 HydrophobicContact CD2-CG 4.41Å; F59-F76 AromaticContact CE2-CD1 3.6Å; F59-F76 HydrophobicContact CE2-CD1 3.6Å; F59-F76 AromaticContact CE2-CE1 3.91Å; F59-F76 HydrophobicContact CE2-CE1 3.91Å; F59-F76 HydrophobicContact CE2-CG 4.38Å; F59-I77 CarbonylContact C-O 3.56Å; F59-I77 WeakPolarHBondContact CA-O 3.33Å; F59-I77 VanDerWaalsContact CB-O 3.24Å; F59-I77 WeakPolarHBondContact CB-O 3.28Å; F59-Y78 HydrophobicContact CB-CD1 3.45Å; F59-Y78 VanDerWaalsContact CB-CD1 3.45Å; F59-Y78 HydrophobicContact CB-CE1 3.93Å; F59-Y78 HydrophobicContact CB-CG 4Å; F59-Y78 AromaticContact CD2-CD1 3.85Å; F59-Y78 HydrophobicContact CD2-CD1 3.85Å; F59-Y78 AromaticContact CD2-CE1 3.37Å; F59-Y78 HydrophobicContact CD2-CE1 3.37Å; F59-Y78 AromaticContact CD2-CZ 3.87Å; F59-Y78 AromaticContact CE2-CE1 3.97Å; F59-Y78 HydrophobicContact CE2-CE1 3.97Å; F59-Y78 AromaticContact CG-CD1 3.88Å; F59-Y78 HydrophobicContact CG-CD1 3.88Å; F59-Y78 AromaticContact CG-CE1 3.83Å; F59-Y78 HydrophobicContact CG-CE1 3.83Å; F59-F160 HydrophobicContact CB-CE1 4.34Å; F59-F160 HydrophobicContact CB-CE2 4.17Å; F59-F160 HydrophobicContact CB-CZ 3.73Å; F59-F160 AromaticContact CD1-CE1 3.87Å; F59-F160 HydrophobicContact CD1-CE1 3.87Å; F59-F160 HydrophobicContact CD1-CE2 4.46Å; F59-F160 AromaticContact CD1-CZ 3.39Å; F59-F160 HydrophobicContact CD1-CZ 3.39Å; F59-F160 HydrophobicContact CD2-CE1 4.4Å; F59-F160 HydrophobicContact CD2-CZ 4.49Å; F59-F160 HydrophobicContact CE1-CE1 4.12Å; F59-F160 AromaticContact CE1-CZ 4Å; F59-F160 HydrophobicContact CE1-CZ 4Å; F59-F160 AromaticContact CG-CE1 3.96Å; F59-F160 HydrophobicContact CG-CE1 3.96Å; F59-F160 AromaticContact CG-CZ 3.63Å; F59-F160 HydrophobicContact CG-CZ 3.63Å; F59-F160 HydrophobicContact CZ-CE1 4.43Å; F59-A162 HydrophobicContact CD1-CB 4.02Å; F59-A162 HydrophobicContact CE1-CB 3.5Å; F59-A162 HydrophobicContact CZ-CB 4.3Å; F59-S163 WeakPolarHBondContact CE1-O 3.24Å; F59-S163 WeakPolarHBondContact CZ-O 3.34Å; F59-P165 HydrophobicContact CE1-CG 4.46Å; F59-P165 HydrophobicContact CE2-CG 4.21Å; F59-P165 HydrophobicContact CZ-CG 4.13Å; F59-R174 HydrophobicContact CE2-CB 4.1Å; F59-R174 HydrophobicContact CE2-CG 3.84Å; F59-R174 HydrophobicContact CZ-CB 4.18Å; F59-R174 HydrophobicContact CZ-CG 4.15Å
60	M	97.2	Very high	92.3	Very high	7 Å²	7	48.7 Å²	48.7	3%	0.034	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	159.2	179.3	67.8	-178.5	57.1	0	0	111.3	I46 N48 D49 S52 I53 F76 I77	I46-M60 HydrophobicContact CD1-SD 3.71Å; N48-M60 HydrophobicContact CB-SD 3.7Å; D49-M60 WeakPolarHBondContact O-CE 3.25Å; S52-M60 WeakPolarHBondContact OG-CE 3.37Å; I53-M60 HydrophobicContact CB-CE 3.88Å; I53-M60 HydrophobicContact CD1-CE 3.73Å; I53-M60 HydrophobicContact CD1-CG 4.35Å; I53-M60 HydrophobicContact CG1-CE 3.43Å; I53-M60 VanDerWaalsContact CG1-CE 3.43Å; I53-M60 HydrophobicContact CG2-CB 4.06Å; I53-M60 HydrophobicContact CG2-CE 3.36Å; I53-M60 HydrophobicContact CG2-CG 4.43Å; M60-F76 CarbonylContact O-C 3.49Å; M60-F76 VanDerWaalsContact O-CA 3.28Å; M60-F76 WeakPolarHBondContact O-CA 3.09Å; M60-I77 HydrophobicContact CG-CB 3.93Å; M60-I77 HydrophobicContact CG-CG1 4.17Å; M60-I77 PolarHBondContact N-O 3.21Å; M60-I77 PolarHBondContact O-N 3.05Å
61	Y	98.3	Very high	92.4	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.016	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	142.3	160	-177.6	-119.5	0	0	0	109.9	N48 L63 D74 A75 F76 R166 S231	N48-Y61 PolarHBondContact ND2-O 3.22Å; Y61-L63 HydrophobicContact CE1-CD2 4.45Å; Y61-D74 HydrophobicContact CE2-CB 3.85Å; Y61-D74 WeakPolarHBondContact OH-CB 3.43Å; Y61-A75 WeakPolarHBondContact CD2-O 3.07Å; Y61-F76 HydrophobicContact CD2-CD1 4.31Å; Y61-F76 HydrophobicContact CD2-CE1 4.12Å; Y61-F76 HydrophobicContact CD2-CE2 4.48Å; Y61-F76 HydrophobicContact CD2-CZ 4.26Å; Y61-R166 HydrophobicContact CD1-CG 3.97Å; Y61-R166 HydrophobicContact CD2-CG 4.3Å; Y61-R166 HydrophobicContact CG-CG 3.77Å; Y61-S231 WeakPolarHBondContact CD1-OG 3.37Å; Y61-S231 WeakPolarHBondContact CE1-OG 3.43Å
62	S	98.3	Very high	92.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	172	175.6	-168.6	0	0	0	0	110.7	I46 T47 N48 A75	I46-S62 WeakPolarHBondContact CB-OG 3.38Å; T47-S62 PolarHBondContact N-OG 2.9Å; T47-S62 PolarHBondContact OG1-OG 2.8Å; N48-S62 WeakPolarHBondContact CB-OG 3.46Å; N48-S62 PolarHBondContact N-OG 2.97Å; S62-A75 PolarHBondContact N-O 2.98Å; S62-A75 PolarHBondContact O-N 2.93Å
63	L	98.1	Very high	92.6	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	153.8	171.9	-52.8	171.2	0	0	0	110.1	I46 T47 Y61 L65 V71 D74 P223 A228	I46-L63 WeakPolarHBondContact CA-O 3.4Å; T47-L63 HydrophobicContact CG2-CB 3.92Å; T47-L63 PolarHBondContact N-O 2.94Å; T47-L63 PolarHBondContact OG1-N 3.05Å; T47-L63 PolarHBondContact OG1-O 3.49Å; Y61-L63 HydrophobicContact CE1-CD2 4.45Å; L63-L65 HydrophobicContact CB-CD2 4.08Å; L63-V71 HydrophobicContact CD1-CG2 3.89Å; L63-V71 HydrophobicContact CD2-CG1 4.25Å; L63-D74 HydrophobicContact CD2-CB 3.79Å; L63-P223 HydrophobicContact CD1-CB 3.69Å; L63-P223 HydrophobicContact CD1-CG 4Å; L63-A228 HydrophobicContact CD1-CB 3.52Å; L63-A228 HydrophobicContact CG-CB 4.2Å
64	F	98	Very high	92.8	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	134.8	159	-72.5	-91.2	0	0	0	108.9	L42 L45 I46 L72 T73 A75 I77 V92 L102 L106	L42-F64 HydrophobicContact CD2-CE1 4.42Å; L42-F64 HydrophobicContact CD2-CZ 4.19Å; L45-F64 HydrophobicContact CB-CD1 4.22Å; L45-F64 HydrophobicContact CB-CE1 4.01Å; I46-F64 HydrophobicContact CG2-CD1 4.19Å; I46-F64 HydrophobicContact CG2-CE1 3.54Å; I46-F64 HydrophobicContact CG2-CE2 3.95Å; I46-F64 HydrophobicContact CG2-CZ 3.41Å; I46-F64 VanDerWaalsContact CG2-CZ 3.41Å; F64-L72 HydrophobicContact CB-CB 4.42Å; F64-L72 WeakPolarHBondContact O-CB 3.21Å; F64-L72 PolarHBondContact O-N 2.77Å; F64-T73 HydrophobicContact CB-CG2 4.23Å; F64-T73 HydrophobicContact CD2-CG2 4.15Å; F64-T73 PolarHBondContact N-O 3.37Å; F64-T73 PolarHBondContact O-N 3.04Å; F64-A75 HydrophobicContact CD2-CB 3.99Å; F64-A75 HydrophobicContact CE2-CB 3.79Å; F64-I77 HydrophobicContact CE2-CD1 4.08Å; F64-I77 HydrophobicContact CZ-CD1 4.33Å; F64-V92 HydrophobicContact CE2-CG1 3.62Å; F64-V92 HydrophobicContact CZ-CG1 4.03Å; F64-L102 HydrophobicContact CB-CD1 4.13Å; F64-L102 HydrophobicContact CD1-CD1 3.76Å; F64-L102 HydrophobicContact CD2-CD1 3.88Å; F64-L102 HydrophobicContact CD2-CD2 4.11Å; F64-L102 HydrophobicContact CE1-CD1 4.08Å; F64-L102 HydrophobicContact CE2-CD1 4.19Å; F64-L102 HydrophobicContact CE2-CD2 4.03Å; F64-L102 HydrophobicContact CG-CD1 3.64Å; F64-L102 HydrophobicContact CZ-CD1 4.28Å; F64-L106 HydrophobicContact CE1-CD2 3.76Å; F64-L106 HydrophobicContact CZ-CD2 4.3Å
65	L	97.5	Very high	93.5	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	153.9	179.7	-50.4	-173.7	0	0	0	111.5	T47 L63 R70 V71 H105 P223 Y241	T47-L65 HydrophobicContact CG2-CD1 3.72Å; T47-L65 HydrophobicContact CG2-CD2 3.95Å; T47-L65 HydrophobicContact CG2-CG 3.65Å; L63-L65 HydrophobicContact CB-CD2 4.08Å; L65-R70 CarbonylContact C-O 3.6Å; L65-R70 VanDerWaalsContact CA-O 3.23Å; L65-R70 WeakPolarHBondContact CA-O 3.45Å; L65-V71 HydrophobicContact CD2-CG2 4.06Å; L65-H105 PolarHBondContact O-CE1 3.34Å; L65-P223 HydrophobicContact CD1-CG 4.04Å; L65-P223 HydrophobicContact CD2-CG 3.76Å; L65-Y241 HydrophobicContact CD1-CE2 3.92Å
66	N	95.9	Very high	94.4	Very high	31 Å²	31	28.5 Å²	28.5	17%	0.166	15%	0.151	C	C	.	.			trans	-76.4	171.5	161.1	69.5	23.1	0	0	0	110.9	K68 G69 R70 G243	N66-K68 PolarHBondContact O-N 2.93Å; N66-K68 WeakPolarHBondContact OD1-CA 3.41Å; N66-K68 WeakPolarHBondContact OD1-CB 3.37Å; N66-K68 PolarHBondContact OD1-N 3.18Å; N66-G69 PolarHBondContact O-N 3.35Å; N66-G69 PolarHBondContact OD1-N 3.42Å; N66-R70 PolarHBondContact N-O 2.84Å; N66-R70 PolarHBondContact OD1-N 3.4Å; N66-G243 WeakPolarHBondContact O-CA 3.28Å
67	S	95.5	Very high	95.7	Very high	88 Å²	88	25.4 Å²	25.4	62%	0.615	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.6	179.3	55.5	0	0	0	0	114.3	G69	S67-G69 VanDerWaalsContact C-N 3.32Å
68	K	96.2	Very high	96.6	Very high	162 Å²	162	21.5 Å²	21.5	70%	0.704	11%	0.11	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	1.2	175.7	-57.9	179.5	179.1	178	0	112.9	N66 R70	N66-K68 PolarHBondContact O-N 2.93Å; N66-K68 WeakPolarHBondContact OD1-CA 3.41Å; N66-K68 WeakPolarHBondContact OD1-CB 3.37Å; N66-K68 PolarHBondContact OD1-N 3.18Å; K68-R70 HydrophobicContact CB-CG 4.41Å
69	G	96.5	Very high	96.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.102	C	C	.	.	S	Bend	trans	76.3	23.9	-179.2	0	0	0	0	0	114.6	N66 S67 G243	N66-G69 PolarHBondContact O-N 3.35Å; N66-G69 PolarHBondContact OD1-N 3.42Å; S67-G69 VanDerWaalsContact C-N 3.32Å; G69-G243 WeakPolarHBondContact CA-O 3.48Å
70	R	96.2	Very high	96.3	Very high	67 Å²	67	19.4 Å²	19.4	25%	0.253	10%	0.097	S	C	.	.			trans	-100.7	148.4	174.2	-48.1	-60.8	-165.8	-170	-4.7	110.9	L65 N66 K68 L72 S219 D220 T221	L65-R70 CarbonylContact C-O 3.6Å; L65-R70 VanDerWaalsContact CA-O 3.23Å; L65-R70 WeakPolarHBondContact CA-O 3.45Å; N66-R70 PolarHBondContact N-O 2.84Å; N66-R70 PolarHBondContact OD1-N 3.4Å; K68-R70 HydrophobicContact CB-CG 4.41Å; R70-L72 PolarHBondContact O-N 3.27Å; R70-S219 WeakPolarHBondContact CB-O 3.34Å; R70-S219 VanDerWaalsContact CG-O 3.26Å; R70-S219 WeakPolarHBondContact CG-O 3.49Å; R70-D220 WeakPolarHBondContact CD-O 3.43Å; R70-T221 WeakPolarHBondContact CA-O 3.49Å
71	V	96.5	Very high	95.4	Very high	3 Å²	3	23.3 Å²	23.3	2%	0.018	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	121.3	-179.9	-178	0	0	0	0	110.3	L63 L65 S219 T221 P223	L63-V71 HydrophobicContact CD1-CG2 3.89Å; L63-V71 HydrophobicContact CD2-CG1 4.25Å; L65-V71 HydrophobicContact CD2-CG2 4.06Å; V71-S219 PolarHBondContact O-N 3.07Å; V71-T221 HydrophobicContact CG2-CG2 4.2Å; V71-T221 WeakPolarHBondContact CG2-O 3.24Å; V71-T221 PolarHBondContact N-O 2.99Å; V71-P223 HydrophobicContact CG2-CG 4.34Å
72	L	95.6	Very high	94.3	Very high	36 Å²	36	28.8 Å²	28.8	19%	0.188	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	-48.8	167.9	-179.9	65.6	0	0	0	110	F64 R70 L102 H105	F64-L72 HydrophobicContact CB-CB 4.42Å; F64-L72 WeakPolarHBondContact O-CB 3.21Å; F64-L72 PolarHBondContact O-N 2.77Å; R70-L72 PolarHBondContact O-N 3.27Å; L72-L102 HydrophobicContact CD2-CD1 4.35Å; L72-H105 HydrophobicContact CD2-CB 3.88Å
73	T	96.9	Very high	93.1	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.018	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	151.4	177.1	-171.7	0	0	0	0	110.1	F64 V94 L102	F64-T73 HydrophobicContact CB-CG2 4.23Å; F64-T73 HydrophobicContact CD2-CG2 4.15Å; F64-T73 PolarHBondContact N-O 3.37Å; F64-T73 PolarHBondContact O-N 3.04Å; T73-V94 HydrophobicContact CG2-CG1 3.89Å; T73-L102 HydrophobicContact CG2-CD1 4.38Å; T73-L102 HydrophobicContact CG2-CD2 3.99Å
74	D	97.3	Very high	91.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	145	165.4	69.3	-56.9	0	0	0	110.8	R28 Y61 L63 G212 F216	R28-D74 IonicContact CZ-OD2 3.49Å; R28-D74 IonicContact NH2-OD1 3.64Å; R28-D74 PolarHBondContact NH2-OD1 3.22Å; R28-D74 IonicContact NH2-OD2 3.78Å; R28-D74 PolarHBondContact NH2-OD2 3.38Å; R28-D74 VanDerWaalsContact NH2-OD2 3.1Å; Y61-D74 HydrophobicContact CE2-CB 3.85Å; Y61-D74 WeakPolarHBondContact OH-CB 3.43Å; L63-D74 HydrophobicContact CD2-CB 3.79Å; D74-G212 WeakPolarHBondContact OD1-CA 3.37Å; D74-G212 PolarHBondContact OD1-N 3.33Å; D74-F216 HydrophobicContact CB-CE2 3.59Å; D74-F216 HydrophobicContact CB-CZ 4.09Å; D74-F216 WeakPolarHBondContact OD1-CE2 3.37Å
75	A	98.1	Very high	89.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	147.2	-176.2	0	0	0	0	0	112.8	Y61 S62 F64 I77 V92 E93 V94	Y61-A75 WeakPolarHBondContact CD2-O 3.07Å; S62-A75 PolarHBondContact N-O 2.98Å; S62-A75 PolarHBondContact O-N 2.93Å; F64-A75 HydrophobicContact CD2-CB 3.99Å; F64-A75 HydrophobicContact CE2-CB 3.79Å; A75-I77 HydrophobicContact CB-CD1 3.97Å; A75-V92 HydrophobicContact CB-CG1 3.98Å; A75-E93 WeakPolarHBondContact CA-O 3.16Å; A75-V94 HydrophobicContact CB-CG1 3.82Å
76	F	98.3	Very high	88.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	134.1	156.2	-68.8	-83.5	0	0	0	109.6	F59 M60 Y61 Y78 V92 E93 P165 R166	F59-F76 HydrophobicContact CD2-CB 4.32Å; F59-F76 AromaticContact CD2-CD1 3.78Å; F59-F76 HydrophobicContact CD2-CD1 3.78Å; F59-F76 HydrophobicContact CD2-CG 4.41Å; F59-F76 AromaticContact CE2-CD1 3.6Å; F59-F76 HydrophobicContact CE2-CD1 3.6Å; F59-F76 AromaticContact CE2-CE1 3.91Å; F59-F76 HydrophobicContact CE2-CE1 3.91Å; F59-F76 HydrophobicContact CE2-CG 4.38Å; M60-F76 CarbonylContact O-C 3.49Å; M60-F76 VanDerWaalsContact O-CA 3.28Å; M60-F76 WeakPolarHBondContact O-CA 3.09Å; Y61-F76 HydrophobicContact CD2-CD1 4.31Å; Y61-F76 HydrophobicContact CD2-CE1 4.12Å; Y61-F76 HydrophobicContact CD2-CE2 4.48Å; Y61-F76 HydrophobicContact CD2-CZ 4.26Å; F76-Y78 HydrophobicContact CB-CD2 4.4Å; F76-Y78 HydrophobicContact CB-CE2 3.59Å; F76-V92 CarbonylContact O-C 3.51Å; F76-V92 WeakPolarHBondContact O-CA 3.48Å; F76-E93 HydrophobicContact CB-CB 4.15Å; F76-E93 PolarHBondContact N-O 2.83Å; F76-E93 VanDerWaalsContact N-O 3.08Å; F76-E93 PolarHBondContact O-N 3.08Å; F76-P165 HydrophobicContact CE1-CG 4.07Å; F76-R166 HydrophobicContact CE1-CG 4.41Å; F76-R166 VanDerWaalsContact CZ-NE 3.28Å
77	I	97.8	Very high	86.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	118.7	178.2	-43.2	-62.8	0	0	0	108.2	L42 I46 I50 I53 F59 M60 F64 A75 Y90 L91 V92	L42-I77 HydrophobicContact CD1-CG2 4.27Å; I46-I77 HydrophobicContact CD1-CG1 4.3Å; I46-I77 HydrophobicContact CG2-CD1 4.32Å; I50-I77 HydrophobicContact CD1-CG2 3.8Å; I53-I77 HydrophobicContact CD1-CB 4.21Å; I53-I77 HydrophobicContact CD1-CG2 3.94Å; I53-I77 WeakPolarHBondContact CD1-O 3.27Å; F59-I77 CarbonylContact C-O 3.56Å; F59-I77 WeakPolarHBondContact CA-O 3.33Å; F59-I77 VanDerWaalsContact CB-O 3.24Å; F59-I77 WeakPolarHBondContact CB-O 3.28Å; M60-I77 HydrophobicContact CG-CB 3.93Å; M60-I77 HydrophobicContact CG-CG1 4.17Å; M60-I77 PolarHBondContact N-O 3.21Å; M60-I77 PolarHBondContact O-N 3.05Å; F64-I77 HydrophobicContact CE2-CD1 4.08Å; F64-I77 HydrophobicContact CZ-CD1 4.33Å; A75-I77 HydrophobicContact CB-CD1 3.97Å; I77-Y90 HydrophobicContact CG2-CD1 4.03Å; I77-L91 CarbonylContact C-O 3.59Å; I77-L91 WeakPolarHBondContact CA-O 3.24Å; I77-V92 HydrophobicContact CD1-CB 4.2Å; I77-V92 HydrophobicContact CD1-CG1 3.76Å; I77-V92 HydrophobicContact CD1-CG2 3.85Å
78	Y	95.8	Very high	85.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	134.4	-179.4	-55.7	-95.7	0	0	0	110.1	L30 F59 F76 Y90 L91 E93 F160 R174 L176	L30-Y78 HydrophobicContact CD2-CD2 4.35Å; L30-Y78 HydrophobicContact CD2-CE2 4.27Å; F59-Y78 HydrophobicContact CB-CD1 3.45Å; F59-Y78 VanDerWaalsContact CB-CD1 3.45Å; F59-Y78 HydrophobicContact CB-CE1 3.93Å; F59-Y78 HydrophobicContact CB-CG 4Å; F59-Y78 AromaticContact CD2-CD1 3.85Å; F59-Y78 HydrophobicContact CD2-CD1 3.85Å; F59-Y78 AromaticContact CD2-CE1 3.37Å; F59-Y78 HydrophobicContact CD2-CE1 3.37Å; F59-Y78 AromaticContact CD2-CZ 3.87Å; F59-Y78 AromaticContact CE2-CE1 3.97Å; F59-Y78 HydrophobicContact CE2-CE1 3.97Å; F59-Y78 AromaticContact CG-CD1 3.88Å; F59-Y78 HydrophobicContact CG-CD1 3.88Å; F59-Y78 AromaticContact CG-CE1 3.83Å; F59-Y78 HydrophobicContact CG-CE1 3.83Å; F76-Y78 HydrophobicContact CB-CD2 4.4Å; F76-Y78 HydrophobicContact CB-CE2 3.59Å; Y78-Y90 VanDerWaalsContact O-CA 3.27Å; Y78-Y90 WeakPolarHBondContact O-CA 3.42Å; Y78-L91 HydrophobicContact CD2-CB 4.28Å; Y78-L91 PolarHBondContact N-O 2.95Å; Y78-L91 PolarHBondContact O-N 2.93Å; Y78-E93 HydrophobicContact CE2-CB 3.75Å; Y78-E93 WeakPolarHBondContact CE2-OE2 3.49Å; Y78-E93 PolarHBondContact OH-OE2 2.96Å; Y78-F160 AromaticContact CD1-CD1 3.5Å; Y78-F160 HydrophobicContact CD1-CD1 3.5Å; Y78-F160 HydrophobicContact CD1-CD2 4.01Å; Y78-F160 AromaticContact CD1-CE1 3.58Å; Y78-F160 HydrophobicContact CD1-CE1 3.58Å; Y78-F160 HydrophobicContact CD1-CE2 4.04Å; Y78-F160 AromaticContact CD1-CG 3.75Å; Y78-F160 HydrophobicContact CD1-CG 3.75Å; Y78-F160 AromaticContact CD1-CZ 3.87Å; Y78-F160 HydrophobicContact CD1-CZ 3.87Å; Y78-F160 AromaticContact CE1-CD1 3.51Å; Y78-F160 HydrophobicContact CE1-CD1 3.51Å; Y78-F160 AromaticContact CE1-CE1 3.51Å; Y78-F160 HydrophobicContact CE1-CE1 3.51Å; Y78-F160 HydrophobicContact CE1-CG 4.21Å; Y78-F160 HydrophobicContact CE1-CZ 4.2Å; Y78-R174 HydrophobicContact CE1-CB 4.4Å; Y78-L176 HydrophobicContact CD1-CD1 3.88Å; Y78-L176 HydrophobicContact CD1-CG 4.4Å; Y78-L176 HydrophobicContact CD2-CD1 3.84Å; Y78-L176 HydrophobicContact CE1-CD1 4.1Å; Y78-L176 HydrophobicContact CE1-CD2 4.46Å; Y78-L176 HydrophobicContact CE1-CG 4.19Å; Y78-L176 HydrophobicContact CE2-CD1 4.05Å; Y78-L176 HydrophobicContact CE2-CD2 4.26Å; Y78-L176 HydrophobicContact CG-CD1 3.75Å
79	H	92.6	Very high	84.9	Confident	7 Å²	7	38.7 Å²	38.7	3%	0.032	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.5	168.2	-178.5	-147	0	0	0	109.9	I53 N54 Q55 N57 S58 S88 Y90	I53-H79 HydrophobicContact CD1-CB 4.23Å; I53-H79 HydrophobicContact CG1-CB 4.39Å; I53-H79 VanDerWaalsContact O-CB 3.24Å; I53-H79 WeakPolarHBondContact O-CB 3.33Å; I53-H79 PolarHBondContact O-ND1 2.93Å; N54-H79 PolarHBondContact O-CE1 3.36Å; Q55-H79 VanDerWaalsContact C-ND1 3.34Å; Q55-H79 PolarHBondContact O-ND1 3.34Å; N57-H79 PolarHBondContact N-O 3.46Å; S58-H79 PolarHBondContact O-N 3Å; H79-S88 VanDerWaalsContact NE2-CB 3.26Å; H79-S88 WeakPolarHBondContact NE2-CB 3.46Å; H79-S88 PolarHBondContact NE2-OG 2.87Å; H79-Y90 HydrophobicContact CB-CD1 4.32Å; H79-Y90 HydrophobicContact CB-CE1 4Å
80	T	85.4	Confident	84.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	149.6	178.9	-173.5	0	0	0	0	111.3	R82 L83 D89 L91 I159	T80-R82 PolarHBondContact OG1-N 2.98Å; T80-L83 HydrophobicContact CG2-CD1 4.26Å; T80-D89 HydrophobicContact CG2-CB 4.18Å; T80-D89 PolarHBondContact N-O 2.96Å; T80-D89 PolarHBondContact O-N 3.19Å; T80-D89 VanDerWaalsContact O-O 3.13Å; T80-L91 HydrophobicContact CG2-CD1 3.84Å; T80-L91 HydrophobicContact CG2-CG 4.15Å; T80-I159 HydrophobicContact CG2-CG2 4.28Å
81	N	78.7	Confident	84.8	Confident	89 Å²	89	36.1 Å²	36.1	48%	0.476	20%	0.199	S	C	.	.	S	Bend	trans	-114.6	13.2	172.8	63.5	-10	0	0	0	111.6
82	R	75.7	Confident	84.8	Confident	119 Å²	119	36 Å²	36	45%	0.449	20%	0.198	S	C	.	.	S	Bend	trans	-88.3	-13.5	-175.5	-66.9	-166.7	179.3	-152.1	-5.2	114.3	T80 Q155 L158 I159	T80-R82 PolarHBondContact OG1-N 2.98Å; R82-Q155 PolarHBondContact NH1-O 3.22Å; R82-L158 PolarHBondContact NH1-O 3.21Å; R82-I159 WeakPolarHBondContact CD-O 3.42Å
83	L	72.5	Confident	85	Confident	70 Å²	70	34.2 Å²	34.2	37%	0.366	19%	0.19	S	C	.	.	S	Bend	trans	-93.4	-44.4	-175.7	-73.2	173.8	0	0	0	112.7	T80 D89 L91 V123 I159	T80-L83 HydrophobicContact CG2-CD1 4.26Å; L83-D89 HydrophobicContact CB-CB 4.5Å; L83-D89 WeakPolarHBondContact CB-OD2 3.45Å; L83-L91 HydrophobicContact CD1-CD1 3.81Å; L83-L91 HydrophobicContact CD1-CD2 3.54Å; L83-L91 HydrophobicContact CD1-CG 3.96Å; L83-V123 HydrophobicContact CD2-CG2 4.22Å; L83-I159 HydrophobicContact CD2-CD1 3.77Å; L83-I159 HydrophobicContact CG-CD1 4.37Å
84	S	67.9	Low	85	Confident	25 Å²	25	34.1 Å²	34.1	18%	0.175	19%	0.189	C	C	.	.	S	Bend	trans	-116.5	134.6	176.1	64.3	0	0	0	0	112.2	H34 N86 Q87 D89	H34-S84 PolarHBondContact CE1-OG 2.62Å; S84-N86 PolarHBondContact O-N 3.49Å; S84-Q87 PolarHBondContact OG-O 2.83Å; S84-D89 VanDerWaalsContact CB-OD2 3.28Å; S84-D89 WeakPolarHBondContact CB-OD2 3.46Å; S84-D89 PolarHBondContact N-OD2 2.97Å; S84-D89 PolarHBondContact OG-OD1 2.84Å; S84-D89 PolarHBondContact OG-OD2 3.05Å
85	A	61.1	Low	85	Confident	91 Å²	91	34.6 Å²	34.6	75%	0.752	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	118	173.3	0	0	0	0	0	109.2
86	N	59.7	Low	84.9	Confident	170 Å²	170	38.1 Å²	38.1	91%	0.909	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.2	13.4	173.2	-49.6	-35.2	0	0	0	117.7	S84	S84-N86 PolarHBondContact O-N 3.49Å
87	Q	66.1	Low	84.8	Confident	73 Å²	73	40.9 Å²	40.9	34%	0.341	23%	0.232	S	C	.	.	S	Bend	trans	-130.2	153.1	171.5	-61.3	-167	5.2	0	0	112	H34 S84	H34-Q87 PolarHBondContact CE1-OE1 3.32Å; H34-Q87 PolarHBondContact NE2-OE1 3.04Å; S84-Q87 PolarHBondContact OG-O 2.83Å
88	S	68.3	Low	84.8	Confident	57 Å²	57	41.2 Å²	41.2	40%	0.399	23%	0.234	S	C	.	.			trans	-79.7	118.8	173.6	-72.2	0	0	0	0	108.9	H79	H79-S88 VanDerWaalsContact NE2-CB 3.26Å; H79-S88 WeakPolarHBondContact NE2-CB 3.46Å; H79-S88 PolarHBondContact NE2-OG 2.87Å
89	D	85.5	Confident	84.9	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.011	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	133.5	172.3	-65	-49.8	0	0	0	109.4	H34 T80 L83 S84	H34-D89 IonicContact CE1-OD1 2.94Å; H34-D89 IonicContact CG-OD1 3.96Å; H34-D89 IonicContact ND1-OD1 3.58Å; H34-D89 PolarHBondContact ND1-OD1 3.41Å; T80-D89 HydrophobicContact CG2-CB 4.18Å; T80-D89 PolarHBondContact N-O 2.96Å; T80-D89 PolarHBondContact O-N 3.19Å; T80-D89 VanDerWaalsContact O-O 3.13Å; L83-D89 HydrophobicContact CB-CB 4.5Å; L83-D89 WeakPolarHBondContact CB-OD2 3.45Å; S84-D89 VanDerWaalsContact CB-OD2 3.28Å; S84-D89 WeakPolarHBondContact CB-OD2 3.46Å; S84-D89 PolarHBondContact N-OD2 2.97Å; S84-D89 PolarHBondContact OG-OD1 2.84Å; S84-D89 PolarHBondContact OG-OD2 3.05Å
90	Y	94.5	Very high	85.1	Confident	13 Å²	13	46 Å²	46	5%	0.051	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.4	166.9	-67.8	-83.1	0	0	0	109.4	C32 V33 A38 D39 L42 I50 I53 I77 Y78 H79	C32-Y90 WeakPolarHBondContact CA-O 3.5Å; V33-Y90 PolarHBondContact N-O 3.39Å; V33-Y90 PolarHBondContact O-N 3.03Å; V33-Y90 VanDerWaalsContact O-N 3.16Å; A38-Y90 HydrophobicContact CB-CD2 3.72Å; A38-Y90 HydrophobicContact CB-CE2 4.1Å; D39-Y90 HydrophobicContact CB-CE2 3.89Å; D39-Y90 WeakPolarHBondContact CB-OH 3.49Å; L42-Y90 VanDerWaalsContact CD1-CB 3.41Å; L42-Y90 HydrophobicContact CD1-CD1 4.14Å; L42-Y90 HydrophobicContact CD1-CD2 4.02Å; L42-Y90 HydrophobicContact CD1-CG 3.59Å; I50-Y90 HydrophobicContact CD1-CD1 3.91Å; I50-Y90 HydrophobicContact CD1-CE1 3.68Å; I50-Y90 HydrophobicContact CG1-CD1 4.39Å; I50-Y90 HydrophobicContact CG1-CE1 3.71Å; I53-Y90 HydrophobicContact CD1-CD1 4.16Å; I53-Y90 HydrophobicContact CD1-CE1 3.97Å; I53-Y90 HydrophobicContact CG1-CE1 4.24Å; I77-Y90 HydrophobicContact CG2-CD1 4.03Å; Y78-Y90 VanDerWaalsContact O-CA 3.27Å; Y78-Y90 WeakPolarHBondContact O-CA 3.42Å; H79-Y90 HydrophobicContact CB-CD1 4.32Å; H79-Y90 HydrophobicContact CB-CE1 4Å
91	L	96	Very high	85.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.2	171.2	-60.4	169.6	0	0	0	109.7	L30 I31 C32 I77 Y78 T80 L83 L121 I159 L176	L30-L91 HydrophobicContact CD2-CB 3.91Å; I31-L91 CarbonylContact O-C 3.46Å; I31-L91 WeakPolarHBondContact O-CA 3.46Å; C32-L91 HydrophobicContact CB-CD2 3.85Å; I77-L91 CarbonylContact C-O 3.59Å; I77-L91 WeakPolarHBondContact CA-O 3.24Å; Y78-L91 HydrophobicContact CD2-CB 4.28Å; Y78-L91 PolarHBondContact N-O 2.95Å; Y78-L91 PolarHBondContact O-N 2.93Å; T80-L91 HydrophobicContact CG2-CD1 3.84Å; T80-L91 HydrophobicContact CG2-CG 4.15Å; L83-L91 HydrophobicContact CD1-CD1 3.81Å; L83-L91 HydrophobicContact CD1-CD2 3.54Å; L83-L91 HydrophobicContact CD1-CG 3.96Å; L91-L121 HydrophobicContact CD2-CD1 3.84Å; L91-I159 HydrophobicContact CD1-CG2 4.24Å; L91-L176 HydrophobicContact CD1-CD1 3.77Å
92	V	98	Very high	86.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	102.5	-177.6	-177	0	0	0	0	108	L30 I31 V33 F64 A75 F76 I77 V94 L102	L30-V92 CarbonylContact C-O 3.6Å; L30-V92 WeakPolarHBondContact CA-O 3.39Å; I31-V92 HydrophobicContact CB-CB 4.34Å; I31-V92 PolarHBondContact N-O 3.39Å; I31-V92 PolarHBondContact O-N 3.21Å; V33-V92 HydrophobicContact CG2-CG2 4.19Å; F64-V92 HydrophobicContact CE2-CG1 3.62Å; F64-V92 HydrophobicContact CZ-CG1 4.03Å; A75-V92 HydrophobicContact CB-CG1 3.98Å; F76-V92 CarbonylContact O-C 3.51Å; F76-V92 WeakPolarHBondContact O-CA 3.48Å; I77-V92 HydrophobicContact CD1-CB 4.2Å; I77-V92 HydrophobicContact CD1-CG1 3.76Å; I77-V92 HydrophobicContact CD1-CG2 3.85Å; V92-V94 HydrophobicContact CG1-CG1 4.09Å; V92-L102 HydrophobicContact CG1-CD2 3.92Å
93	E	98.2	Very high	87.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	123.6	176.2	177.5	-172	138.4	0	0	110.2	R28 S29 L30 A75 F76 Y78 P125 R174	R28-E93 HydrophobicContact CB-CG 4.12Å; R28-E93 VanDerWaalsContact CD-OE1 3.31Å; R28-E93 WeakPolarHBondContact CD-OE1 3.29Å; R28-E93 IonicContact NE-OE1 2.87Å; S29-E93 WeakPolarHBondContact O-CA 3.42Å; L30-E93 HydrophobicContact CD2-CB 3.69Å; L30-E93 HydrophobicContact CD2-CG 4.5Å; A75-E93 WeakPolarHBondContact CA-O 3.16Å; F76-E93 HydrophobicContact CB-CB 4.15Å; F76-E93 PolarHBondContact N-O 2.83Å; F76-E93 VanDerWaalsContact N-O 3.08Å; F76-E93 PolarHBondContact O-N 3.08Å; Y78-E93 HydrophobicContact CE2-CB 3.75Å; Y78-E93 WeakPolarHBondContact CE2-OE2 3.49Å; Y78-E93 PolarHBondContact OH-OE2 2.96Å; E93-P125 HydrophobicContact CG-CB 4.27Å; E93-R174 IonicContact OE1-NE 3.53Å
94	V	97.9	Very high	88.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	167.9	177.9	-67	0	0	0	0	110.6	R28 S29 I31 T73 A75 V92 V96 V99 L102	R28-V94 CarbonylContact C-O 3.5Å; R28-V94 VanDerWaalsContact CA-O 3.22Å; R28-V94 WeakPolarHBondContact CA-O 3.46Å; R28-V94 WeakPolarHBondContact CB-O 3.35Å; S29-V94 PolarHBondContact N-O 3.15Å; S29-V94 PolarHBondContact O-N 3.03Å; I31-V94 HydrophobicContact CD1-CG2 4.32Å; T73-V94 HydrophobicContact CG2-CG1 3.89Å; A75-V94 HydrophobicContact CB-CG1 3.82Å; V92-V94 HydrophobicContact CG1-CG1 4.09Å; V94-V96 PolarHBondContact O-N 3.17Å; V94-V99 HydrophobicContact CG2-CG2 3.82Å; V94-L102 HydrophobicContact CG1-CD2 3.6Å; V94-L102 HydrophobicContact CG2-CD2 4.25Å
95	D	97.3	Very high	90.1	Very high	10 Å²	10	45 Å²	45	5%	0.053	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	131.6	164.4	-174.5	-47.9	0	0	0	109.7	E27 S97 C98 G212 I213	E27-D95 CarbonylContact O-C 3.58Å; E27-D95 WeakPolarHBondContact O-CA 3.11Å; D95-S97 VanDerWaalsContact CG-OG 3.32Å; D95-S97 PolarHBondContact O-N 2.93Å; D95-S97 VanDerWaalsContact O-N 3.15Å; D95-S97 VanDerWaalsContact OD1-CB 3.31Å; D95-S97 WeakPolarHBondContact OD1-CB 3.23Å; D95-S97 PolarHBondContact OD1-N 3.07Å; D95-S97 PolarHBondContact OD1-OG 2.75Å; D95-C98 HydrophobicContact CB-CB 4.4Å; D95-C98 WeakPolarHBondContact O-CA 3.32Å; D95-C98 WeakPolarHBondContact O-CB 3.49Å; D95-C98 PolarHBondContact O-N 3.03Å; D95-G212 WeakPolarHBondContact OD2-CA 3.29Å; D95-I213 PolarHBondContact OD2-N 2.72Å
96	V	96.9	Very high	91.9	Very high	75 Å²	75	40.7 Å²	40.7	46%	0.455	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-55.7	-34	-176.8	66.6	0	0	0	0	112	E27 V94 C98 V99	E27-V96 WeakPolarHBondContact O-CG1 3.4Å; E27-V96 PolarHBondContact O-N 2.91Å; V94-V96 PolarHBondContact O-N 3.17Å; V96-C98 PolarHBondContact O-N 2.94Å; V96-V99 WeakPolarHBondContact O-CB 3.38Å; V96-V99 WeakPolarHBondContact O-CG2 3.42Å; V96-V99 PolarHBondContact O-N 2.99Å
97	S	95.9	Very high	93.7	Very high	58 Å²	58	38.8 Å²	38.8	41%	0.406	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-69.8	-21.8	177.5	68.9	0	0	0	0	113.2	D95 I213	D95-S97 VanDerWaalsContact CG-OG 3.32Å; D95-S97 PolarHBondContact O-N 2.93Å; D95-S97 VanDerWaalsContact O-N 3.15Å; D95-S97 VanDerWaalsContact OD1-CB 3.31Å; D95-S97 WeakPolarHBondContact OD1-CB 3.23Å; D95-S97 PolarHBondContact OD1-N 3.07Å; D95-S97 PolarHBondContact OD1-OG 2.75Å; S97-I213 WeakPolarHBondContact OG-CG2 3.48Å
98	C	96.2	Very high	95.1	Very high	7 Å²	7	40.8 Å²	40.8	5%	0.047	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-84	-16.8	177.4	-66.4	0	0	0	0	113.1	D95 V96 N101 L102	D95-C98 HydrophobicContact CB-CB 4.4Å; D95-C98 WeakPolarHBondContact O-CA 3.32Å; D95-C98 WeakPolarHBondContact O-CB 3.49Å; D95-C98 PolarHBondContact O-N 3.03Å; V96-C98 PolarHBondContact O-N 2.94Å; C98-N101 PolarHBondContact O-N 3.2Å; C98-L102 WeakPolarHBondContact O-CB 3.32Å; C98-L102 PolarHBondContact O-N 3.06Å
99	V	97.8	Very high	96.5	Very high	19 Å²	19	41.7 Å²	41.7	12%	0.115	21%	0.213	C	C	.	.	H	α-helix	trans	-52.5	-50.5	-174.9	172.6	0	0	0	0	112.8	I31 V94 V96 N101 L102 V103 A119	I31-V99 HydrophobicContact CD1-CG1 4.26Å; I31-V99 HydrophobicContact CG1-CG1 4.21Å; V94-V99 HydrophobicContact CG2-CG2 3.82Å; V96-V99 WeakPolarHBondContact O-CB 3.38Å; V96-V99 WeakPolarHBondContact O-CG2 3.42Å; V96-V99 PolarHBondContact O-N 2.99Å; V99-N101 VanDerWaalsContact C-N 3.33Å; V99-N101 PolarHBondContact O-N 2.88Å; V99-L102 PolarHBondContact O-N 3.2Å; V99-V103 HydrophobicContact CG1-CG2 4.13Å; V99-V103 WeakPolarHBondContact O-CB 3.41Å; V99-V103 VanDerWaalsContact O-CG2 3.26Å; V99-V103 WeakPolarHBondContact O-CG2 3.42Å; V99-V103 PolarHBondContact O-N 3.42Å; V99-A119 HydrophobicContact CG1-CB 3.87Å
100	P	97.1	Very high	97	Very high	88 Å²	88	42.9 Å²	42.9	57%	0.571	22%	0.22	S	C	*	.	H	α-helix	trans	-61.6	-41.8	-177.9	-22.7	34.6	0	0	0	112.8	K104	P100-K104 WeakPolarHBondContact O-CB 3.47Å; P100-K104 PolarHBondContact O-N 2.94Å
101	N	95.9	Very high	96.9	Very high	95 Å²	95	49.9 Å²	49.9	51%	0.508	26%	0.257	S	S	.	.	H	α-helix	trans	-70.6	-40.2	-179.2	-73.8	-26.2	0	0	0	111.7	C98 V99 K104 H105	C98-N101 PolarHBondContact O-N 3.2Å; V99-N101 VanDerWaalsContact C-N 3.33Å; V99-N101 PolarHBondContact O-N 2.88Å; N101-K104 PolarHBondContact O-N 3.46Å; N101-H105 WeakPolarHBondContact O-CB 3.12Å; N101-H105 PolarHBondContact O-N 2.94Å
102	L	97.6	Very high	96.6	Very high	1 Å²	1	60 Å²	60	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-69	-43.2	176.7	-178	58.2	0	0	0	111.3	I31 F64 L72 T73 V92 V94 C98 V99 K104 H105 L106	I31-L102 HydrophobicContact CD1-CB 4.14Å; I31-L102 HydrophobicContact CD1-CD2 3.78Å; I31-L102 HydrophobicContact CD1-CG 3.99Å; F64-L102 HydrophobicContact CB-CD1 4.13Å; F64-L102 HydrophobicContact CD1-CD1 3.76Å; F64-L102 HydrophobicContact CD2-CD1 3.88Å; F64-L102 HydrophobicContact CD2-CD2 4.11Å; F64-L102 HydrophobicContact CE1-CD1 4.08Å; F64-L102 HydrophobicContact CE2-CD1 4.19Å; F64-L102 HydrophobicContact CE2-CD2 4.03Å; F64-L102 HydrophobicContact CG-CD1 3.64Å; F64-L102 HydrophobicContact CZ-CD1 4.28Å; L72-L102 HydrophobicContact CD2-CD1 4.35Å; T73-L102 HydrophobicContact CG2-CD1 4.38Å; T73-L102 HydrophobicContact CG2-CD2 3.99Å; V92-L102 HydrophobicContact CG1-CD2 3.92Å; V94-L102 HydrophobicContact CG1-CD2 3.6Å; V94-L102 HydrophobicContact CG2-CD2 4.25Å; C98-L102 WeakPolarHBondContact O-CB 3.32Å; C98-L102 PolarHBondContact O-N 3.06Å; V99-L102 PolarHBondContact O-N 3.2Å; L102-K104 VanDerWaalsContact C-N 3.29Å; L102-K104 PolarHBondContact O-N 3.24Å; L102-H105 CarbonylContact O-C 3.59Å; L102-H105 WeakPolarHBondContact O-CA 3.4Å; L102-H105 WeakPolarHBondContact O-CB 3.37Å; L102-H105 PolarHBondContact O-N 2.95Å; L102-H105 VanDerWaalsContact O-N 3.09Å; L102-L106 HydrophobicContact CD1-CD2 4.38Å; L102-L106 HydrophobicContact CD1-CG 4.12Å; L102-L106 HydrophobicContact CG-CD1 4.18Å; L102-L106 HydrophobicContact CG-CG 4.25Å; L102-L106 VanDerWaalsContact O-CG 3.32Å; L102-L106 WeakPolarHBondContact O-CG 3.15Å; L102-L106 PolarHBondContact O-N 3.45Å
103	V	98.3	Very high	96.2	Very high	22 Å²	22	62.6 Å²	62.6	13%	0.133	32%	0.322	C	S	.	.	H	α-helix	trans	-58.4	-42.9	174.7	170.4	0	0	0	0	111	I31 V99 L106 K107 I117 A119	I31-V103 HydrophobicContact CD1-CG2 3.8Å; I31-V103 HydrophobicContact CG1-CG2 4.14Å; I31-V103 HydrophobicContact CG2-CG2 4.4Å; V99-V103 HydrophobicContact CG1-CG2 4.13Å; V99-V103 WeakPolarHBondContact O-CB 3.41Å; V99-V103 VanDerWaalsContact O-CG2 3.26Å; V99-V103 WeakPolarHBondContact O-CG2 3.42Å; V99-V103 PolarHBondContact O-N 3.42Å; V103-L106 PolarHBondContact O-N 2.77Å; V103-K107 HydrophobicContact CG1-CD 4.02Å; V103-K107 HydrophobicContact CG1-CG 4.46Å; V103-K107 WeakPolarHBondContact O-CB 3.45Å; V103-K107 WeakPolarHBondContact O-CG 3.48Å; V103-K107 PolarHBondContact O-N 3.26Å; V103-I117 HydrophobicContact CG1-CG2 4.37Å; V103-I117 HydrophobicContact CG2-CG2 4.46Å; V103-A119 HydrophobicContact CG2-CB 3.89Å
104	K	97.6	Very high	95.9	Very high	147 Å²	147	67.6 Å²	67.6	64%	0.639	34%	0.344	S	S	*	.	H	α-helix	trans	-60.1	-45.6	173.8	-178.8	-179.4	177.5	-179.7	0	111.6	P100 N101 L102 K107 Q108	P100-K104 WeakPolarHBondContact O-CB 3.47Å; P100-K104 PolarHBondContact O-N 2.94Å; N101-K104 PolarHBondContact O-N 3.46Å; L102-K104 VanDerWaalsContact C-N 3.29Å; L102-K104 PolarHBondContact O-N 3.24Å; K104-K107 PolarHBondContact O-N 3.09Å; K104-Q108 WeakPolarHBondContact O-CB 3.04Å; K104-Q108 PolarHBondContact O-N 3.36Å
105	H	97.2	Very high	95.7	Very high	17 Å²	17	68 Å²	68	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-60.6	-49.2	177.5	-176.5	95.1	0	0	0	111.8	L65 L72 N101 L102 K107 Q108 Y109	L65-H105 PolarHBondContact O-CE1 3.34Å; L72-H105 HydrophobicContact CD2-CB 3.88Å; N101-H105 WeakPolarHBondContact O-CB 3.12Å; N101-H105 PolarHBondContact O-N 2.94Å; L102-H105 CarbonylContact O-C 3.59Å; L102-H105 WeakPolarHBondContact O-CA 3.4Å; L102-H105 WeakPolarHBondContact O-CB 3.37Å; L102-H105 PolarHBondContact O-N 2.95Å; L102-H105 VanDerWaalsContact O-N 3.09Å; H105-K107 PolarHBondContact O-N 3.05Å; H105-Q108 WeakPolarHBondContact O-CB 3.14Å; H105-Q108 PolarHBondContact O-N 3.48Å; H105-Y109 AromaticContact CE1-CE2 3.43Å; H105-Y109 VanDerWaalsContact CE1-CE2 3.43Å; H105-Y109 WeakPolarHBondContact CE1-CE2 3.08Å; H105-Y109 AromaticContact ND1-CE2 3.82Å; H105-Y109 AromaticContact NE2-CD2 3.82Å; H105-Y109 AromaticContact NE2-CE2 3.57Å; H105-Y109 VanDerWaalsContact O-CD2 3.24Å; H105-Y109 WeakPolarHBondContact O-CD2 3.46Å; H105-Y109 PolarHBondContact O-N 2.72Å
106	L	98.1	Very high	95.6	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-59.8	-46.3	177.1	-64.5	174.3	0	0	0	111.2	I31 V33 F41 L45 F64 L102 V103 Q108 Y109 N110 I117	I31-L106 HydrophobicContact CG2-CD1 4.16Å; V33-L106 HydrophobicContact CG2-CD1 4.23Å; F41-L106 HydrophobicContact CE1-CB 4.44Å; F41-L106 HydrophobicContact CE1-CD2 3.98Å; F41-L106 HydrophobicContact CZ-CB 4.24Å; F41-L106 HydrophobicContact CZ-CD2 4.2Å; F41-L106 WeakPolarHBondContact CZ-O 3.23Å; L45-L106 HydrophobicContact CD1-CD2 3.78Å; F64-L106 HydrophobicContact CE1-CD2 3.76Å; F64-L106 HydrophobicContact CZ-CD2 4.3Å; L102-L106 HydrophobicContact CD1-CD2 4.38Å; L102-L106 HydrophobicContact CD1-CG 4.12Å; L102-L106 HydrophobicContact CG-CD1 4.18Å; L102-L106 HydrophobicContact CG-CG 4.25Å; L102-L106 VanDerWaalsContact O-CG 3.32Å; L102-L106 WeakPolarHBondContact O-CG 3.15Å; L102-L106 PolarHBondContact O-N 3.45Å; V103-L106 PolarHBondContact O-N 2.77Å; L106-Q108 VanDerWaalsContact C-N 3.32Å; L106-Q108 PolarHBondContact O-N 2.97Å; L106-Y109 PolarHBondContact O-N 3.35Å; L106-N110 WeakPolarHBondContact O-CB 3.33Å; L106-N110 PolarHBondContact O-N 3.27Å; L106-I117 HydrophobicContact CB-CD1 3.57Å; L106-I117 HydrophobicContact CB-CG1 4.34Å; L106-I117 HydrophobicContact CD1-CG2 4.15Å
107	K	97.2	Very high	95.5	Very high	131 Å²	131	71.4 Å²	71.4	57%	0.57	36%	0.355	S	S	*	.	H	α-helix	trans	-61.5	-38.2	177.5	-75.1	178.4	178.4	179	0	112.6	V103 K104 H105 Y109 N110 I117	V103-K107 HydrophobicContact CG1-CD 4.02Å; V103-K107 HydrophobicContact CG1-CG 4.46Å; V103-K107 WeakPolarHBondContact O-CB 3.45Å; V103-K107 WeakPolarHBondContact O-CG 3.48Å; V103-K107 PolarHBondContact O-N 3.26Å; K104-K107 PolarHBondContact O-N 3.09Å; H105-K107 PolarHBondContact O-N 3.05Å; K107-Y109 VanDerWaalsContact C-N 3.28Å; K107-Y109 PolarHBondContact O-N 3.34Å; K107-N110 PolarHBondContact O-N 2.88Å; K107-I117 HydrophobicContact CG-CD1 3.92Å
108	Q	96.5	Very high	95.4	Very high	115 Å²	115	71 Å²	71	54%	0.537	35%	0.349	S	S	.	.	H	α-helix	trans	-59.5	-37.7	177.4	179.1	-178.4	-19.3	0	0	112.3	K104 H105 L106 L111	K104-Q108 WeakPolarHBondContact O-CB 3.04Å; K104-Q108 PolarHBondContact O-N 3.36Å; H105-Q108 WeakPolarHBondContact O-CB 3.14Å; H105-Q108 PolarHBondContact O-N 3.48Å; L106-Q108 VanDerWaalsContact C-N 3.32Å; L106-Q108 PolarHBondContact O-N 2.97Å; Q108-L111 WeakPolarHBondContact O-CD2 3.14Å
109	Y	96.8	Very high	95.4	Very high	76 Å²	76	72.5 Å²	72.5	30%	0.298	36%	0.362	S	S	.	.	H	α-helix	trans	-90.9	-11.6	179.6	-68.6	-75.2	0	0	0	113.9	L45 H105 L106 K107 L111 I242	L45-Y109 HydrophobicContact CD2-CD1 4.28Å; L45-Y109 HydrophobicContact CD2-CD2 3.69Å; L45-Y109 HydrophobicContact CD2-CE2 4.35Å; L45-Y109 HydrophobicContact CD2-CG 3.68Å; H105-Y109 AromaticContact CE1-CE2 3.43Å; H105-Y109 VanDerWaalsContact CE1-CE2 3.43Å; H105-Y109 WeakPolarHBondContact CE1-CE2 3.08Å; H105-Y109 AromaticContact ND1-CE2 3.82Å; H105-Y109 AromaticContact NE2-CD2 3.82Å; H105-Y109 AromaticContact NE2-CE2 3.57Å; H105-Y109 VanDerWaalsContact O-CD2 3.24Å; H105-Y109 WeakPolarHBondContact O-CD2 3.46Å; H105-Y109 PolarHBondContact O-N 2.72Å; L106-Y109 PolarHBondContact O-N 3.35Å; K107-Y109 VanDerWaalsContact C-N 3.28Å; K107-Y109 PolarHBondContact O-N 3.34Å; Y109-L111 PolarHBondContact O-N 2.76Å; Y109-I242 HydrophobicContact CE1-CD1 4.11Å; Y109-I242 HydrophobicContact CE1-CG1 4.43Å; Y109-I242 HydrophobicContact CE2-CG1 4.49Å; Y109-I242 WeakPolarHBondContact OH-CD1 3.29Å; Y109-I242 WeakPolarHBondContact OH-CG1 3.43Å
110	N	96.1	Very high	95.1	Very high	27 Å²	27	78.5 Å²	78.5	14%	0.144	39%	0.393	C	S	.	.			trans	-83.7	53.7	176.4	-172.5	20.2	0	0	0	112.4	F41 L106 K107 R112 G113 K114 V115 I117	F41-N110 HydrophobicContact CE2-CB 3.9Å; F41-N110 HydrophobicContact CZ-CB 4.07Å; L106-N110 WeakPolarHBondContact O-CB 3.33Å; L106-N110 PolarHBondContact O-N 3.27Å; K107-N110 PolarHBondContact O-N 2.88Å; N110-R112 VanDerWaalsContact C-N 3.27Å; N110-R112 PolarHBondContact O-N 3.41Å; N110-R112 VanDerWaalsContact O-N 3.15Å; N110-G113 PolarHBondContact O-N 2.85Å; N110-G113 WeakPolarHBondContact OD1-CA 3.45Å; N110-G113 PolarHBondContact OD1-N 3.28Å; N110-K114 PolarHBondContact OD1-N 2.69Å; N110-K114 VanDerWaalsContact OD1-N 3.11Å; N110-V115 HydrophobicContact CB-CG2 4.35Å; N110-V115 WeakPolarHBondContact ND2-CG2 3.48Å; N110-V115 PolarHBondContact ND2-O 3.5Å; N110-I117 HydrophobicContact CB-CD1 4.37Å
111	L	92.4	Very high	94.8	Very high	160 Å²	160	76.2 Å²	76.2	84%	0.838	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-32.4	-169.4	-62.8	175.9	0	0	0	114.8	Q108 Y109	Q108-L111 WeakPolarHBondContact O-CD2 3.14Å; Y109-L111 PolarHBondContact O-N 2.76Å
112	R	90.1	Very high	94.6	Very high	212 Å²	212	75.6 Å²	75.6	80%	0.8	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	3.8	-178.6	-67.5	-178.2	-177.4	165.5	2.9	113.3	N110 K114	N110-R112 VanDerWaalsContact C-N 3.27Å; N110-R112 PolarHBondContact O-N 3.41Å; N110-R112 VanDerWaalsContact O-N 3.15Å; R112-K114 HydrophobicContact CB-CG 4.15Å; R112-K114 PolarHBondContact O-N 3.45Å
113	G	89.7	Confident	94.4	Very high	55 Å²	55	75.9 Å²	75.9	57%	0.567	38%	0.381	S	S	*	.			trans	58.6	30.9	-178	0	0	0	0	0	113.9	N110 V115	N110-G113 PolarHBondContact O-N 2.85Å; N110-G113 WeakPolarHBondContact OD1-CA 3.45Å; N110-G113 PolarHBondContact OD1-N 3.28Å; G113-V115 PolarHBondContact O-N 3Å
114	K	90.9	Very high	94.2	Very high	104 Å²	104	78 Å²	78	45%	0.452	39%	0.387	S	S	.	.			trans	-69.8	-22.9	-177.2	-76.3	-171	174	-171.1	0	113.1	N110 R112	N110-K114 PolarHBondContact OD1-N 2.69Å; N110-K114 VanDerWaalsContact OD1-N 3.11Å; R112-K114 HydrophobicContact CB-CG 4.15Å; R112-K114 PolarHBondContact O-N 3.45Å
115	V	94.3	Very high	94.2	Very high	10 Å²	10	71 Å²	71	6%	0.061	36%	0.357	C	S	.	.	S	Bend	trans	-121.7	148.2	-179.9	-58.6	0	0	0	0	110.1	V33 H34 A38 F41 N110 G113 I117	V33-V115 HydrophobicContact CG1-CB 4.22Å; V33-V115 HydrophobicContact CG1-CG2 4.24Å; H34-V115 CarbonylContact O-C 3.48Å; H34-V115 VanDerWaalsContact O-CA 3.24Å; H34-V115 WeakPolarHBondContact O-CA 3.38Å; H34-V115 WeakPolarHBondContact O-CB 3.36Å; A38-V115 HydrophobicContact CB-CG1 4.23Å; F41-V115 HydrophobicContact CB-CG1 4.05Å; F41-V115 HydrophobicContact CD1-CG1 4.39Å; F41-V115 HydrophobicContact CD1-CG2 3.71Å; F41-V115 HydrophobicContact CD2-CG2 4.4Å; F41-V115 HydrophobicContact CE1-CG2 3.86Å; F41-V115 HydrophobicContact CG-CG1 4.3Å; F41-V115 HydrophobicContact CG-CG2 3.98Å; F41-V115 HydrophobicContact CZ-CG2 4.28Å; N110-V115 HydrophobicContact CB-CG2 4.35Å; N110-V115 WeakPolarHBondContact ND2-CG2 3.48Å; N110-V115 PolarHBondContact ND2-O 3.5Å; G113-V115 PolarHBondContact O-N 3Å; V115-I117 HydrophobicContact CG2-CG1 4.4Å
116	K	94.1	Very high	94.1	Very high	130 Å²	130	71.2 Å²	71.2	57%	0.565	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	136.3	167.4	-174.7	-176.1	174.4	-163.1	0	108.4	H34 D118	H34-K116 HydrophobicContact CB-CB 4.39Å; H34-K116 PolarHBondContact N-O 3.31Å; H34-K116 PolarHBondContact O-N 2.8Å; K116-D118 IonicContact NZ-OD2 3.1Å
117	I	96.1	Very high	94	Very high	25 Å²	25	71.2 Å²	71.2	13%	0.128	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	118.5	176.9	-61.2	156.7	0	0	0	107.2	I31 C32 V103 L106 K107 N110 V115	I31-I117 HydrophobicContact CG2-CG2 3.72Å; C32-I117 WeakPolarHBondContact O-CA 3.19Å; V103-I117 HydrophobicContact CG1-CG2 4.37Å; V103-I117 HydrophobicContact CG2-CG2 4.46Å; L106-I117 HydrophobicContact CB-CD1 3.57Å; L106-I117 HydrophobicContact CB-CG1 4.34Å; L106-I117 HydrophobicContact CD1-CG2 4.15Å; K107-I117 HydrophobicContact CG-CD1 3.92Å; N110-I117 HydrophobicContact CB-CD1 4.37Å; V115-I117 HydrophobicContact CG2-CG1 4.4Å
118	D	94.4	Very high	93.8	Very high	50 Å²	50	65 Å²	65	27%	0.267	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.7	-178.2	-158.6	-17.1	0	0	0	110.4	I31 C32 K116 D120	I31-D118 CarbonylContact C-O 3.58Å; I31-D118 WeakPolarHBondContact CA-O 3.48Å; C32-D118 HydrophobicContact CB-CB 4.33Å; C32-D118 PolarHBondContact N-O 2.86Å; C32-D118 PolarHBondContact O-N 2.76Å; K116-D118 IonicContact NZ-OD2 3.1Å; D118-D120 PolarHBondContact OD1-N 2.89Å
119	A	95.4	Very high	93.6	Very high	38 Å²	38	60.5 Å²	60.5	31%	0.314	31%	0.309	S	S	.	.			trans	-115.9	0.2	178.9	0	0	0	0	0	112.1	I31 V99 V103 L121	I31-A119 HydrophobicContact CG1-CB 4.13Å; V99-A119 HydrophobicContact CG1-CB 3.87Å; V103-A119 HydrophobicContact CG2-CB 3.89Å; A119-L121 PolarHBondContact O-N 2.85Å
120	D	91.8	Very high	93.1	Very high	146 Å²	146	57.8 Å²	57.8	78%	0.781	30%	0.301	S	S	*	.			trans	-99.2	78.3	176.6	-170.7	16.7	0	0	0	109	D118	D118-D120 PolarHBondContact OD1-N 2.89Å
121	L	90.5	Very high	92.1	Very high	39 Å²	39	59.4 Å²	59.4	20%	0.204	31%	0.312	C	S	.	.			trans	-115.6	133.6	-175.3	-60.2	173.6	0	0	0	110.6	L30 C32 L91 A119 V123	L30-L121 HydrophobicContact CB-CD1 3.95Å; C32-L121 HydrophobicContact CB-CD1 3.68Å; C32-L121 HydrophobicContact CB-CD2 3.89Å; C32-L121 HydrophobicContact CB-CG 4.33Å; L91-L121 HydrophobicContact CD2-CD1 3.84Å; A119-L121 PolarHBondContact O-N 2.85Å; L121-V123 HydrophobicContact CB-CB 4.48Å; L121-V123 HydrophobicContact CB-CG2 4.34Å; L121-V123 PolarHBondContact O-N 3.08Å
122	S	91.1	Very high	91.2	Very high	83 Å²	83	54.3 Å²	54.3	58%	0.58	29%	0.289	S	S	*	.			trans	-82.8	53.2	166.2	-63.9	0	0	0	0	110.9	T178	S122-T178 WeakPolarHBondContact O-CA 3.5Å
123	V	93.1	Very high	89.9	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.042	28%	0.279	C	S	.	.			trans	-128.4	131.3	175.7	-172.8	0	0	0	0	108.7	L30 L83 L121 I159 L176	L30-V123 HydrophobicContact CD1-CB 3.6Å; L30-V123 HydrophobicContact CD1-CG1 3.3Å; L83-V123 HydrophobicContact CD2-CG2 4.22Å; L121-V123 HydrophobicContact CB-CB 4.48Å; L121-V123 HydrophobicContact CB-CG2 4.34Å; L121-V123 PolarHBondContact O-N 3.08Å; V123-I159 HydrophobicContact CB-CD1 4.19Å; V123-I159 HydrophobicContact CG1-CD1 3.68Å; V123-I159 HydrophobicContact CG2-CD1 3.42Å; V123-I159 VanDerWaalsContact CG2-CD1 3.42Å; V123-L176 HydrophobicContact CG1-CB 4.07Å
124	Y	95.2	Very high	88.5	Confident	65 Å²	65	57.1 Å²	57.1	26%	0.255	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.9	-172.6	-55.4	-78.1	0	0	0	109.6	S177 T178 N180	Y124-S177 WeakPolarHBondContact CD2-O 3.32Å; Y124-S177 PolarHBondContact N-O 3.23Å; Y124-S177 PolarHBondContact O-N 2.96Å; Y124-T178 WeakPolarHBondContact CE2-O 3.34Å; Y124-N180 HydrophobicContact CD1-CB 3.95Å; Y124-N180 HydrophobicContact CD2-CB 3.74Å; Y124-N180 HydrophobicContact CE1-CB 3.85Å; Y124-N180 HydrophobicContact CE2-CB 3.66Å; Y124-N180 HydrophobicContact CG-CB 3.88Å
125	P	96.5	Very high	87.2	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.013	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	138.5	172.4	30.2	-31.6	0	0	0	110.9	L25 R28 E93 L176	L25-P125 HydrophobicContact CB-CB 4.33Å; L25-P125 HydrophobicContact CB-CG 4.19Å; L25-P125 PolarHBondContact N-O 2.79Å; R28-P125 HydrophobicContact CB-CG 3.85Å; R28-P125 WeakPolarHBondContact O-CG 3.37Å; E93-P125 HydrophobicContact CG-CB 4.27Å; P125-L176 HydrophobicContact CB-CD2 3.99Å
126	W	96.5	Very high	85.4	Confident	20 Å²	20	54.3 Å²	54.3	8%	0.076	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	153.3	177.3	-60.5	76.3	0	0	0	109.3	I22 S23 Q24 I175 S179 N180 V183	I22-W126 HydrophobicContact CG2-CB 4.45Å; I22-W126 HydrophobicContact CG2-CE3 3.87Å; S23-W126 CarbonylContact O-C 3.59Å; S23-W126 WeakPolarHBondContact O-CA 3.42Å; Q24-W126 VanDerWaalsContact CA-CE3 3.44Å; Q24-W126 HydrophobicContact CB-CD2 3.8Å; Q24-W126 HydrophobicContact CB-CE3 3.66Å; Q24-W126 HydrophobicContact CB-CH2 3.87Å; Q24-W126 HydrophobicContact CB-CZ2 4.03Å; Q24-W126 HydrophobicContact CB-CZ3 3.7Å; Q24-W126 HydrophobicContact CG-CD2 4.08Å; Q24-W126 HydrophobicContact CG-CE3 4.43Å; Q24-W126 HydrophobicContact CG-CH2 4.42Å; Q24-W126 HydrophobicContact CG-CZ2 4.08Å; W126-I175 HydrophobicContact CB-CB 4.04Å; W126-I175 PolarHBondContact N-O 3.06Å; W126-I175 PolarHBondContact O-N 3.45Å; W126-S179 WeakPolarHBondContact CZ2-O 3.37Å; W126-S179 PolarHBondContact NE1-O 3.47Å; W126-N180 VanDerWaalsContact CZ2-C 3.49Å; W126-N180 WeakPolarHBondContact CZ2-O 3.28Å; W126-V183 HydrophobicContact CD2-CB 4.34Å; W126-V183 HydrophobicContact CD2-CG2 3.85Å; W126-V183 VanDerWaalsContact CE2-CG2 3.46Å; W126-V183 HydrophobicContact CE3-CB 4.43Å; W126-V183 HydrophobicContact CE3-CG2 4.35Å; W126-V183 HydrophobicContact CG-CG2 4.3Å; W126-V183 HydrophobicContact CH2-CG2 4.21Å; W126-V183 HydrophobicContact CZ2-CG2 3.66Å
127	V	95.6	Very high	84.2	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.3	172.4	62.7	0	0	0	0	109.9	I22 S23 L25 M129 G173 L195 I197 Y200	I22-V127 VanDerWaalsContact CA-O 3.31Å; I22-V127 WeakPolarHBondContact CA-O 3.39Å; S23-V127 PolarHBondContact N-O 3.34Å; S23-V127 PolarHBondContact O-N 3.24Å; L25-V127 HydrophobicContact CD1-CB 4.26Å; L25-V127 HydrophobicContact CD2-CB 4.08Å; L25-V127 HydrophobicContact CD2-CG1 3.69Å; L25-V127 HydrophobicContact CG-CB 4.17Å; L25-V127 HydrophobicContact CG-CG1 4.16Å; V127-M129 HydrophobicContact CG2-CG 4.47Å; V127-G173 CarbonylContact C-O 3.6Å; V127-G173 WeakPolarHBondContact CA-O 3.32Å; V127-G173 WeakPolarHBondContact CG2-O 3.47Å; V127-L195 HydrophobicContact CG1-CD2 3.89Å; V127-I197 HydrophobicContact CG1-CD1 4.26Å; V127-Y200 HydrophobicContact CB-CD2 4.37Å; V127-Y200 HydrophobicContact CB-CE2 4.4Å; V127-Y200 HydrophobicContact CG1-CD2 4.27Å; V127-Y200 HydrophobicContact CG1-CG 4.18Å; V127-Y200 HydrophobicContact CG2-CD2 3.59Å; V127-Y200 HydrophobicContact CG2-CE2 3.69Å; V127-Y200 HydrophobicContact CG2-CG 4.33Å
128	A	93.6	Very high	83.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	141.1	168.7	0	0	0	0	0	109.8	L20 S21 I22 W144 S172 G173 I175	L20-A128 HydrophobicContact CD1-CB 3.91Å; L20-A128 HydrophobicContact CD2-CB 4.36Å; L20-A128 HydrophobicContact CG-CB 4.23Å; S21-A128 CarbonylContact O-C 3.59Å; S21-A128 VanDerWaalsContact O-CA 3.29Å; S21-A128 WeakPolarHBondContact O-CA 3.46Å; I22-A128 HydrophobicContact CG1-CB 4.16Å; A128-W144 HydrophobicContact CB-CE3 4.09Å; A128-W144 HydrophobicContact CB-CZ3 3.59Å; A128-S172 CarbonylContact O-C 3.53Å; A128-S172 WeakPolarHBondContact O-CA 3.3Å; A128-S172 WeakPolarHBondContact O-CB 3.37Å; A128-G173 PolarHBondContact N-O 2.96Å; A128-G173 PolarHBondContact O-N 3.47Å; A128-I175 HydrophobicContact CB-CD1 3.88Å
129	M	90.9	Very high	82.8	Confident	22 Å²	22	53.2 Å²	53.2	11%	0.108	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	145.2	174.2	-73.7	-174.5	69.7	0	0	110.8	S21 V127 L195 Y200 A203	S21-M129 PolarHBondContact N-O 2.99Å; S21-M129 PolarHBondContact O-N 3.31Å; V127-M129 HydrophobicContact CG2-CG 4.47Å; M129-L195 HydrophobicContact CB-CD1 4.29Å; M129-L195 HydrophobicContact CB-CD2 4.1Å; M129-L195 HydrophobicContact CG-CD2 3.82Å; M129-L195 HydrophobicContact SD-CD1 4.05Å; M129-L195 HydrophobicContact SD-CD2 3.81Å; M129-Y200 VanDerWaalsContact SD-CA 3.5Å; M129-Y200 HydrophobicContact SD-CD2 4.34Å; M129-A203 HydrophobicContact CE-CB 3.63Å
130	P	86.6	Confident	82.1	Confident	18 Å²	18	54.2 Å²	54.2	12%	0.117	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	142.5	164.8	27.3	-30.9	0	0	0	110	S132 S135 W171	P130-S132 VanDerWaalsContact C-N 3.29Å; P130-S132 PolarHBondContact O-N 2.82Å; P130-S135 WeakPolarHBondContact CB-O 3.39Å; P130-S135 WeakPolarHBondContact CB-OG 3.46Å; P130-W171 VanDerWaalsContact CD-O 3.29Å; P130-W171 WeakPolarHBondContact CD-O 3.45Å
131	T	75.4	Confident	81.4	Confident	62 Å²	62	53.5 Å²	53.5	38%	0.38	27%	0.267	S	S	.	.	S	Bend	trans	-77.3	-14.7	179	57.2	0	0	0	0	113.9	L19 S21	L19-T131 HydrophobicContact CB-CG2 3.67Å; L19-T131 WeakPolarHBondContact CB-OG1 3.21Å; S21-T131 VanDerWaalsContact OG-CG2 3.31Å; S21-T131 WeakPolarHBondContact OG-CG2 3.24Å
132	S	72.8	Confident	80.7	Confident	52 Å²	52	57.9 Å²	57.9	36%	0.364	29%	0.286	S	S	.	.	S	Bend	trans	-123.6	140.5	178.1	81.7	0	0	0	0	110.6	P130 H134 S135	P130-S132 VanDerWaalsContact C-N 3.29Å; P130-S132 PolarHBondContact O-N 2.82Å; S132-H134 PolarHBondContact O-N 2.73Å; S132-S135 PolarHBondContact O-N 3.05Å; S132-S135 PolarHBondContact O-OG 2.82Å; S132-S135 WeakPolarHBondContact OG-CB 3.35Å; S132-S135 PolarHBondContact OG-N 2.89Å; S132-S135 PolarHBondContact OG-OG 3.27Å
133	R	63.6	Low	79.8	Confident	157 Å²	157	54.5 Å²	54.5	59%	0.592	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-26.9	176.2	-70.3	-174.8	174.9	-151.8	-10.7	112.7	S135 E206	R133-S135 VanDerWaalsContact C-N 3.3Å; R133-S135 PolarHBondContact O-N 3.5Å; R133-E206 IonicContact CZ-OE1 3.69Å; R133-E206 IonicContact NH2-OE1 3.42Å; R133-E206 PolarHBondContact NH2-OE1 2.91Å; R133-E206 IonicContact NH2-OE2 3Å; R133-E206 PolarHBondContact NH2-OE2 2.8Å
134	H	61	Low	79.2	Confident	169 Å²	169	54.3 Å²	54.3	78%	0.782	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-5.3	177.6	-60.8	-61.9	0	0	0	113.8	S132	S132-H134 PolarHBondContact O-N 2.73Å
135	S	61.9	Low	78.6	Confident	23 Å²	23	52.4 Å²	52.4	16%	0.161	26%	0.258	C	S	.	.			trans	-108.3	41.4	-177.9	63.8	0	0	0	0	112.9	P130 S132 R133 Q137	P130-S135 WeakPolarHBondContact CB-O 3.39Å; P130-S135 WeakPolarHBondContact CB-OG 3.46Å; S132-S135 PolarHBondContact O-N 3.05Å; S132-S135 PolarHBondContact O-OG 2.82Å; S132-S135 WeakPolarHBondContact OG-CB 3.35Å; S132-S135 PolarHBondContact OG-N 2.89Å; S132-S135 PolarHBondContact OG-OG 3.27Å; R133-S135 VanDerWaalsContact C-N 3.3Å; R133-S135 PolarHBondContact O-N 3.5Å; S135-Q137 WeakPolarHBondContact O-CB 3.36Å; S135-Q137 PolarHBondContact O-N 2.81Å
136	N	58.4	Low	77.9	Confident	32 Å²	32	53 Å²	53	17%	0.171	26%	0.261	C	S	.	.			trans	-64.3	72.7	170.1	-86.4	4.1	0	0	0	111.6	T396	N136-T396 VanDerWaalsContact CG-OXT 3.23Å; N136-T396 PolarHBondContact ND2-O 2.87Å; N136-T396 PolarHBondContact ND2-OXT 3.36Å
137	Q	69	Low	76.7	Confident	78 Å²	78	53.8 Å²	53.8	36%	0.364	27%	0.268	S	S	.	.			trans	-127.8	5.3	-164.5	-68	-177.4	-7.9	0	0	112.6	S135 N139 N140	S135-Q137 WeakPolarHBondContact O-CB 3.36Å; S135-Q137 PolarHBondContact O-N 2.81Å; Q137-N139 WeakPolarHBondContact CA-OD1 3.5Å; Q137-N139 PolarHBondContact O-N 3.09Å; Q137-N139 VanDerWaalsContact O-N 3.12Å; Q137-N139 PolarHBondContact O-OD1 3.34Å; Q137-N140 PolarHBondContact O-N 2.98Å
138	L	81.4	Confident	75.1	Confident	12 Å²	12	60 Å²	60	6%	0.063	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-12.8	176.2	-58.1	-175.5	0	0	0	112	L20 N140 W144 S163	L20-L138 HydrophobicContact CD1-CD2 3.65Å; L138-N140 PolarHBondContact O-N 3.46Å; L138-W144 HydrophobicContact CB-CZ2 4.14Å; L138-W144 HydrophobicContact CD2-CB 4.31Å; L138-W144 HydrophobicContact CD2-CD2 3.75Å; L138-W144 HydrophobicContact CD2-CE3 4.12Å; L138-W144 HydrophobicContact CD2-CG 3.83Å; L138-W144 PolarHBondContact O-NE1 2.98Å; L138-S163 PolarHBondContact O-OG 2.86Å
139	N	78.3	Confident	73.1	Confident	93 Å²	93	61.3 Å²	61.3	50%	0.497	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-27.3	169.2	64.6	-5.6	0	0	0	112.9	Q137 Y141 S163 S169	Q137-N139 WeakPolarHBondContact CA-OD1 3.5Å; Q137-N139 PolarHBondContact O-N 3.09Å; Q137-N139 VanDerWaalsContact O-N 3.12Å; Q137-N139 PolarHBondContact O-OD1 3.34Å; N139-Y141 PolarHBondContact O-N 3.34Å; N139-S163 PolarHBondContact N-OG 2.77Å; N139-S169 WeakPolarHBondContact CB-OG 3.33Å
140	N	80.1	Confident	71	Confident	59 Å²	59	67.9 Å²	67.9	32%	0.316	35%	0.346	S	S	.	.	S	Bend	trans	-83	104.8	171	-179.2	-5.9	0	0	0	108.8	Q137 L138 E142 A143	Q137-N140 PolarHBondContact O-N 2.98Å; L138-N140 PolarHBondContact O-N 3.46Å; N140-E142 PolarHBondContact O-N 3.11Å; N140-E142 WeakPolarHBondContact OD1-CB 3.42Å; N140-E142 PolarHBondContact OD1-N 3.04Å; N140-A143 HydrophobicContact CB-CB 3.93Å; N140-A143 WeakPolarHBondContact O-CB 3.39Å; N140-A143 PolarHBondContact O-N 2.96Å
141	Y	78.1	Confident	69.1	Low	131 Å²	131	72.4 Å²	72.4	51%	0.514	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-52.8	-40.5	176.9	-178.9	-91.4	0	0	0	113.2	N139 A143 W144 S145 F161	N139-Y141 PolarHBondContact O-N 3.34Å; Y141-A143 PolarHBondContact O-N 3.28Å; Y141-W144 PolarHBondContact O-N 2.69Å; Y141-S145 PolarHBondContact O-N 3.39Å; Y141-S145 VanDerWaalsContact O-N 3.14Å; Y141-F161 AromaticContact CD2-CE2 3.94Å; Y141-F161 HydrophobicContact CD2-CE2 3.94Å; Y141-F161 AromaticContact CD2-CZ 3.68Å; Y141-F161 HydrophobicContact CD2-CZ 3.68Å; Y141-F161 HydrophobicContact CE1-CZ 4.21Å; Y141-F161 AromaticContact CE2-CE1 3.57Å; Y141-F161 HydrophobicContact CE2-CE1 3.57Å; Y141-F161 AromaticContact CE2-CE2 3.69Å; Y141-F161 HydrophobicContact CE2-CE2 3.69Å; Y141-F161 AromaticContact CE2-CZ 2.96Å; Y141-F161 HydrophobicContact CE2-CZ 2.96Å; Y141-F161 AromaticContact CZ-CE1 3.82Å; Y141-F161 AromaticContact CZ-CZ 3.28Å; Y141-F161 WeakPolarHBondContact OH-CE1 3.48Å; Y141-F161 WeakPolarHBondContact OH-CZ 3.26Å
142	E	75.1	Confident	67.8	Low	131 Å²	131	75.5 Å²	75.5	61%	0.612	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-67.3	-22.3	-179.9	-57.7	179.7	167.9	0	0	112.3	N140 W144	N140-E142 PolarHBondContact O-N 3.11Å; N140-E142 WeakPolarHBondContact OD1-CB 3.42Å; N140-E142 PolarHBondContact OD1-N 3.04Å; E142-W144 PolarHBondContact O-N 3.06Å
143	A	72.4	Confident	66.9	Low	11 Å²	11	76.4 Å²	76.4	9%	0.091	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-66.8	-23.1	-178.7	0	0	0	0	0	114.1	N140 Y141	N140-A143 HydrophobicContact CB-CB 3.93Å; N140-A143 WeakPolarHBondContact O-CB 3.39Å; N140-A143 PolarHBondContact O-N 2.96Å; Y141-A143 PolarHBondContact O-N 3.28Å
144	W	81.6	Confident	66.3	Low	3 Å²	3	71.7 Å²	71.7	1%	0.011	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-150.9	37.5	-173.9	69.6	-50	0	0	0	111	L20 A128 L138 Y141 E142 F161 A162 G173 I175 F187	L20-W144 HydrophobicContact CD1-CE3 4.32Å; L20-W144 HydrophobicContact CD2-CB 4.3Å; L20-W144 HydrophobicContact CD2-CE3 4.05Å; A128-W144 HydrophobicContact CB-CE3 4.09Å; A128-W144 HydrophobicContact CB-CZ3 3.59Å; L138-W144 HydrophobicContact CB-CZ2 4.14Å; L138-W144 HydrophobicContact CD2-CB 4.31Å; L138-W144 HydrophobicContact CD2-CD2 3.75Å; L138-W144 HydrophobicContact CD2-CE3 4.12Å; L138-W144 HydrophobicContact CD2-CG 3.83Å; L138-W144 PolarHBondContact O-NE1 2.98Å; Y141-W144 PolarHBondContact O-N 2.69Å; E142-W144 PolarHBondContact O-N 3.06Å; W144-F161 HydrophobicContact CD2-CD2 4.37Å; W144-F161 HydrophobicContact CE3-CD2 4.46Å; W144-F161 HydrophobicContact CH2-CD2 4.12Å; W144-F161 HydrophobicContact CZ2-CD2 4.06Å; W144-F161 HydrophobicContact CZ3-CD2 4.34Å; W144-A162 WeakPolarHBondContact CH2-O 3.21Å; W144-G173 VanDerWaalsContact CH2-CA 3.46Å; W144-I175 HydrophobicContact CZ3-CD1 4.22Å; W144-I175 HydrophobicContact CZ3-CG1 4.13Å; W144-F187 HydrophobicContact CE3-CE1 4.31Å; W144-F187 VanDerWaalsContact O-CD1 3.22Å; W144-F187 WeakPolarHBondContact O-CD1 3.38Å; W144-F187 WeakPolarHBondContact O-CE1 3.26Å
145	S	81.8	Confident	66	Low	25 Å²	25	67.4 Å²	67.4	18%	0.175	36%	0.355	C	S	.	.			trans	-68.3	140.6	176.8	63.8	0	0	0	0	110.5	Y141 S189	Y141-S145 PolarHBondContact O-N 3.39Å; Y141-S145 VanDerWaalsContact O-N 3.14Å; S145-S189 PolarHBondContact O-OG 3.31Å
146	P	82	Confident	66.2	Low	14 Å²	14	73.3 Å²	73.3	9%	0.091	38%	0.378	C	S	.	.			trans	-70.9	177.7	176.5	33.2	-39.2	0	0	0	111.7	N148 L158 F161 I186 F187	P146-N148 PolarHBondContact O-N 3.34Å; P146-L158 HydrophobicContact CB-CD2 3.59Å; P146-L158 HydrophobicContact CG-CD2 3.6Å; P146-F161 HydrophobicContact CG-CD1 4.15Å; P146-F161 HydrophobicContact CG-CE1 3.56Å; P146-F161 HydrophobicContact CG-CZ 3.87Å; P146-I186 CarbonylContact C-O 3.5Å; P146-I186 WeakPolarHBondContact CA-O 3.37Å; P146-I186 HydrophobicContact CB-CG2 3.69Å; P146-I186 WeakPolarHBondContact CB-O 3.42Å; P146-F187 HydrophobicContact CB-CD1 4.36Å; P146-F187 HydrophobicContact CB-CE1 4.17Å
147	V	70.8	Confident	67.4	Low	37 Å²	37	74.8 Å²	74.8	22%	0.224	38%	0.383	C	S	.	.			trans	-56.3	122.9	172.9	-157.4	0	0	0	0	110.3	S149 S185 I186 P188	V147-S149 VanDerWaalsContact C-N 3.26Å; V147-S149 WeakPolarHBondContact CG1-OG 3.38Å; V147-S149 PolarHBondContact O-N 3.27Å; V147-S185 WeakPolarHBondContact CG2-O 3.32Å; V147-I186 WeakPolarHBondContact CG2-O 3.42Å; V147-I186 PolarHBondContact N-O 2.98Å; V147-P188 HydrophobicContact CB-CG 4.34Å; V147-P188 HydrophobicContact CG1-CG 4.46Å; V147-P188 HydrophobicContact CG2-CG 3.75Å
148	N	63.2	Low	68.3	Low	130 Å²	130	71.6 Å²	71.6	70%	0.695	37%	0.369	S	S	*	.			trans	-90	33.7	169.4	-78.4	-9.6	0	0	0	112	P146	P146-N148 PolarHBondContact O-N 3.34Å
149	S	51.3	Low	68.6	Low	28 Å²	28	71.3 Å²	71.3	20%	0.196	37%	0.367	C	S	.	.			trans	-86.3	133.4	177.8	59.6	0	0	0	0	109.8	V147 D151 Q155	V147-S149 VanDerWaalsContact C-N 3.26Å; V147-S149 WeakPolarHBondContact CG1-OG 3.38Å; V147-S149 PolarHBondContact O-N 3.27Å; S149-D151 PolarHBondContact O-N 3.14Å; S149-D151 VanDerWaalsContact O-N 3.09Å; S149-Q155 WeakPolarHBondContact O-CG 3.07Å; S149-Q155 PolarHBondContact O-NE2 3.41Å
150	L	46.2	Very low	69.2	Low	161 Å²	161	67 Å²	67	84%	0.843	34%	0.344	S	S	*	.			trans	-65.4	3.4	164.5	-101.5	82.6	0	0	0	112.3	I152	L150-I152 WeakPolarHBondContact O-CG1 3.36Å; L150-I152 PolarHBondContact O-N 3.25Å
151	D	47.2	Very low	69.7	Low	113 Å²	113	65.3 Å²	65.3	60%	0.604	33%	0.334	S	S	*	.			trans	-64.4	112.1	174.3	-73.7	-36.4	0	0	0	109.2	S149 S153	S149-D151 PolarHBondContact O-N 3.14Å; S149-D151 VanDerWaalsContact O-N 3.09Å; D151-S153 PolarHBondContact O-N 3.4Å
152	I	48.9	Very low	70.3	Confident	127 Å²	127	60.1 Å²	60.1	65%	0.651	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-13	-161	-64.7	165.1	0	0	0	113.1	L150 K156	L150-I152 WeakPolarHBondContact O-CG1 3.36Å; L150-I152 PolarHBondContact O-N 3.25Å; I152-K156 HydrophobicContact CG2-CD 4.43Å; I152-K156 VanDerWaalsContact CG2-CE 3.41Å; I152-K156 VanDerWaalsContact CG2-NZ 3.34Å; I152-K156 WeakPolarHBondContact O-CD 3.02Å; I152-K156 WeakPolarHBondContact O-CE 3.18Å; I152-K156 WeakPolarHBondContact O-CG 3.22Å
153	S	53	Low	71.2	Confident	71 Å²	71	55.1 Å²	55.1	50%	0.497	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-43.8	-175.4	60	0	0	0	0	114.8	D151 K156	D151-S153 PolarHBondContact O-N 3.4Å; S153-K156 WeakPolarHBondContact O-CB 3.46Å; S153-K156 PolarHBondContact O-N 2.94Å
154	D	51.5	Low	72.2	Confident	57 Å²	57	54.8 Å²	54.8	31%	0.305	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-33	-165.8	-66.8	-2.1	0	0	0	111.6	K156 Q157	D154-K156 PolarHBondContact O-N 3.18Å; D154-Q157 PolarHBondContact O-N 2.85Å
155	Q	53.6	Low	72.8	Confident	79 Å²	79	57.7 Å²	57.7	37%	0.369	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-21.7	168.1	-73.2	-166.9	-16.5	0	0	113.1	R82 S149 Q157	R82-Q155 PolarHBondContact NH1-O 3.22Å; S149-Q155 WeakPolarHBondContact O-CG 3.07Å; S149-Q155 PolarHBondContact O-NE2 3.41Å; Q155-Q157 VanDerWaalsContact C-N 3.27Å; Q155-Q157 PolarHBondContact O-N 2.78Å
156	K	66.8	Low	73.4	Confident	147 Å²	147	56.6 Å²	56.6	64%	0.639	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-21.8	174.6	-78.6	177.9	-173.5	176.2	0	112.8	I152 S153 D154	I152-K156 HydrophobicContact CG2-CD 4.43Å; I152-K156 VanDerWaalsContact CG2-CE 3.41Å; I152-K156 VanDerWaalsContact CG2-NZ 3.34Å; I152-K156 WeakPolarHBondContact O-CD 3.02Å; I152-K156 WeakPolarHBondContact O-CE 3.18Å; I152-K156 WeakPolarHBondContact O-CG 3.22Å; S153-K156 WeakPolarHBondContact O-CB 3.46Å; S153-K156 PolarHBondContact O-N 2.94Å; D154-K156 PolarHBondContact O-N 3.18Å
157	Q	83.3	Confident	74	Confident	63 Å²	63	56.9 Å²	56.9	29%	0.294	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-42.1	-179.9	-65.4	-175	1.6	0	0	112.4	D154 Q155 I159 S177 T178 I186	D154-Q157 PolarHBondContact O-N 2.85Å; Q155-Q157 VanDerWaalsContact C-N 3.27Å; Q155-Q157 PolarHBondContact O-N 2.78Å; Q157-I159 PolarHBondContact O-N 2.88Å; Q157-S177 CarbonylContact O-C 3.57Å; Q157-S177 VanDerWaalsContact O-CA 3.22Å; Q157-S177 WeakPolarHBondContact O-CA 3.34Å; Q157-S177 PolarHBondContact O-OG 3.27Å; Q157-T178 WeakPolarHBondContact CA-OG1 3.46Å; Q157-T178 PolarHBondContact O-N 2.74Å; Q157-I186 HydrophobicContact CB-CD1 4.31Å
158	L	87.9	Confident	75	Confident	11 Å²	11	56.9 Å²	56.9	6%	0.058	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	122.6	177.8	-175.4	65.9	0	0	0	111	R82 P146 F160 F161 I175 I186	R82-L158 PolarHBondContact NH1-O 3.21Å; P146-L158 HydrophobicContact CB-CD2 3.59Å; P146-L158 HydrophobicContact CG-CD2 3.6Å; L158-F160 WeakPolarHBondContact CD1-O 3.2Å; L158-F161 HydrophobicContact CD1-CB 4.47Å; L158-F161 HydrophobicContact CD2-CD1 4.05Å; L158-I175 HydrophobicContact CD1-CG2 3.7Å; L158-I186 HydrophobicContact CB-CD1 4.2Å; L158-I186 HydrophobicContact CB-CG2 4.03Å; L158-I186 HydrophobicContact CD1-CG2 4.22Å; L158-I186 HydrophobicContact CD2-CG2 3.86Å; L158-I186 HydrophobicContact CG-CG2 4.26Å
159	I	88	Confident	76.2	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-40.7	174.4	-62.6	-167.6	0	0	0	111.2	T80 R82 L83 L91 V123 Q157 L176 T178	T80-I159 HydrophobicContact CG2-CG2 4.28Å; R82-I159 WeakPolarHBondContact CD-O 3.42Å; L83-I159 HydrophobicContact CD2-CD1 3.77Å; L83-I159 HydrophobicContact CG-CD1 4.37Å; L91-I159 HydrophobicContact CD1-CG2 4.24Å; V123-I159 HydrophobicContact CB-CD1 4.19Å; V123-I159 HydrophobicContact CG1-CD1 3.68Å; V123-I159 HydrophobicContact CG2-CD1 3.42Å; V123-I159 VanDerWaalsContact CG2-CD1 3.42Å; Q157-I159 PolarHBondContact O-N 2.88Å; I159-L176 HydrophobicContact CB-CB 4.02Å; I159-L176 HydrophobicContact CG2-CB 4.38Å; I159-L176 PolarHBondContact N-O 3.05Å; I159-T178 HydrophobicContact CD1-CG2 3.73Å; I159-T178 HydrophobicContact CG1-CG2 4.08Å
160	F	90.2	Very high	78	Confident	3 Å²	3	53 Å²	53	1%	0.013	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	148.5	-173.1	-178.9	-88.6	0	0	0	110.7	N57 F59 Y78 L158 A162 I175 L176	N57-F160 VanDerWaalsContact C-CE2 3.49Å; F59-F160 HydrophobicContact CB-CE1 4.34Å; F59-F160 HydrophobicContact CB-CE2 4.17Å; F59-F160 HydrophobicContact CB-CZ 3.73Å; F59-F160 AromaticContact CD1-CE1 3.87Å; F59-F160 HydrophobicContact CD1-CE1 3.87Å; F59-F160 HydrophobicContact CD1-CE2 4.46Å; F59-F160 AromaticContact CD1-CZ 3.39Å; F59-F160 HydrophobicContact CD1-CZ 3.39Å; F59-F160 HydrophobicContact CD2-CE1 4.4Å; F59-F160 HydrophobicContact CD2-CZ 4.49Å; F59-F160 HydrophobicContact CE1-CE1 4.12Å; F59-F160 AromaticContact CE1-CZ 4Å; F59-F160 HydrophobicContact CE1-CZ 4Å; F59-F160 AromaticContact CG-CE1 3.96Å; F59-F160 HydrophobicContact CG-CE1 3.96Å; F59-F160 AromaticContact CG-CZ 3.63Å; F59-F160 HydrophobicContact CG-CZ 3.63Å; F59-F160 HydrophobicContact CZ-CE1 4.43Å; Y78-F160 AromaticContact CD1-CD1 3.5Å; Y78-F160 HydrophobicContact CD1-CD1 3.5Å; Y78-F160 HydrophobicContact CD1-CD2 4.01Å; Y78-F160 AromaticContact CD1-CE1 3.58Å; Y78-F160 HydrophobicContact CD1-CE1 3.58Å; Y78-F160 HydrophobicContact CD1-CE2 4.04Å; Y78-F160 AromaticContact CD1-CG 3.75Å; Y78-F160 HydrophobicContact CD1-CG 3.75Å; Y78-F160 AromaticContact CD1-CZ 3.87Å; Y78-F160 HydrophobicContact CD1-CZ 3.87Å; Y78-F160 AromaticContact CE1-CD1 3.51Å; Y78-F160 HydrophobicContact CE1-CD1 3.51Å; Y78-F160 AromaticContact CE1-CE1 3.51Å; Y78-F160 HydrophobicContact CE1-CE1 3.51Å; Y78-F160 HydrophobicContact CE1-CG 4.21Å; Y78-F160 HydrophobicContact CE1-CZ 4.2Å; L158-F160 WeakPolarHBondContact CD1-O 3.2Å; F160-A162 HydrophobicContact CE1-CB 3.58Å; F160-A162 HydrophobicContact CZ-CB 3.51Å; F160-I175 CarbonylContact O-C 3.53Å; F160-I175 WeakPolarHBondContact O-CA 3.41Å; F160-L176 HydrophobicContact CB-CB 3.91Å; F160-L176 HydrophobicContact CB-CD1 4.02Å; F160-L176 HydrophobicContact CB-CG 3.92Å; F160-L176 HydrophobicContact CD1-CG 4.5Å; F160-L176 PolarHBondContact N-O 3.2Å; F160-L176 PolarHBondContact O-N 3.39Å
161	F	90.8	Very high	80.1	Confident	23 Å²	23	45.8 Å²	45.8	10%	0.101	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	144.7	158.8	79.8	-68.2	0	0	0	111.3	Y141 W144 P146 L158 R174 I175 F187	Y141-F161 AromaticContact CD2-CE2 3.94Å; Y141-F161 HydrophobicContact CD2-CE2 3.94Å; Y141-F161 AromaticContact CD2-CZ 3.68Å; Y141-F161 HydrophobicContact CD2-CZ 3.68Å; Y141-F161 HydrophobicContact CE1-CZ 4.21Å; Y141-F161 AromaticContact CE2-CE1 3.57Å; Y141-F161 HydrophobicContact CE2-CE1 3.57Å; Y141-F161 AromaticContact CE2-CE2 3.69Å; Y141-F161 HydrophobicContact CE2-CE2 3.69Å; Y141-F161 AromaticContact CE2-CZ 2.96Å; Y141-F161 HydrophobicContact CE2-CZ 2.96Å; Y141-F161 AromaticContact CZ-CE1 3.82Å; Y141-F161 AromaticContact CZ-CZ 3.28Å; Y141-F161 WeakPolarHBondContact OH-CE1 3.48Å; Y141-F161 WeakPolarHBondContact OH-CZ 3.26Å; W144-F161 HydrophobicContact CD2-CD2 4.37Å; W144-F161 HydrophobicContact CE3-CD2 4.46Å; W144-F161 HydrophobicContact CH2-CD2 4.12Å; W144-F161 HydrophobicContact CZ2-CD2 4.06Å; W144-F161 HydrophobicContact CZ3-CD2 4.34Å; P146-F161 HydrophobicContact CG-CD1 4.15Å; P146-F161 HydrophobicContact CG-CE1 3.56Å; P146-F161 HydrophobicContact CG-CZ 3.87Å; L158-F161 HydrophobicContact CD1-CB 4.47Å; L158-F161 HydrophobicContact CD2-CD1 4.05Å; F161-R174 CarbonylContact C-O 3.58Å; F161-R174 WeakPolarHBondContact CA-O 3.49Å; F161-I175 HydrophobicContact CB-CG1 4.02Å; F161-F187 HydrophobicContact CB-CZ 4.39Å; F161-F187 HydrophobicContact CD2-CE1 4.15Å; F161-F187 HydrophobicContact CG-CE1 4.41Å
162	A	91.6	Very high	82.3	Confident	23 Å²	23	40.4 Å²	40.4	19%	0.19	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	166	173.7	0	0	0	0	0	111.3	F59 W144 F160 G173 R174	F59-A162 HydrophobicContact CD1-CB 4.02Å; F59-A162 HydrophobicContact CE1-CB 3.5Å; F59-A162 HydrophobicContact CZ-CB 4.3Å; W144-A162 WeakPolarHBondContact CH2-O 3.21Å; F160-A162 HydrophobicContact CE1-CB 3.58Å; F160-A162 HydrophobicContact CZ-CB 3.51Å; A162-G173 CarbonylContact O-C 3.57Å; A162-G173 VanDerWaalsContact O-CA 3.29Å; A162-G173 WeakPolarHBondContact O-CA 3.29Å; A162-R174 PolarHBondContact N-O 2.55Å; A162-R174 PolarHBondContact O-N 2.79Å
163	S	92.2	Very high	84.4	Confident	26 Å²	26	34.3 Å²	34.3	18%	0.182	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	143.1	170	-81.3	0	0	0	0	111.6	F59 L138 N139	F59-S163 WeakPolarHBondContact CE1-O 3.24Å; F59-S163 WeakPolarHBondContact CZ-O 3.34Å; L138-S163 PolarHBondContact O-OG 2.86Å; N139-S163 PolarHBondContact N-OG 2.77Å
164	D	93.9	Very high	86.4	Confident	3 Å²	3	31 Å²	31	2%	0.016	17%	0.171	C	C	.	.			trans	-60.6	125.6	172.5	-168.3	-38.8	0	0	0	109.8	R166 W171 S172 R174	D164-R166 PolarHBondContact O-N 3.01Å; D164-R166 VanDerWaalsContact OD1-CB 3.3Å; D164-R166 WeakPolarHBondContact OD1-CB 3.14Å; D164-R166 WeakPolarHBondContact OD1-CG 3.4Å; D164-R166 PolarHBondContact OD1-N 3.4Å; D164-R166 IonicContact OD1-NE 3.67Å; D164-R166 PolarHBondContact OD1-NE 3.33Å; D164-R166 VanDerWaalsContact OD1-NE 3.14Å; D164-R166 IonicContact OD2-CZ 3.94Å; D164-R166 IonicContact OD2-NE 2.66Å; D164-R166 PolarHBondContact OD2-NE 2.84Å; D164-R166 IonicContact OD2-NH2 2.69Å; D164-R166 PolarHBondContact OD2-NH2 3.36Å; D164-W171 HydrophobicContact CB-CZ2 4.23Å; D164-W171 VanDerWaalsContact OD2-CZ2 3.26Å; D164-W171 WeakPolarHBondContact OD2-CZ2 3.43Å; D164-S172 WeakPolarHBondContact CB-OG 3.32Å; D164-S172 PolarHBondContact N-O 2.95Å; D164-S172 PolarHBondContact OD2-OG 3.14Å; D164-R174 IonicContact OD2-CZ 3.94Å; D164-R174 IonicContact OD2-NH1 3.77Å; D164-R174 PolarHBondContact OD2-NH1 2.81Å; D164-R174 IonicContact OD2-NH2 3.5Å; D164-R174 PolarHBondContact OD2-NH2 2.83Å
165	P	94	Very high	88.4	Confident	65 Å²	65	28.2 Å²	28.2	42%	0.422	16%	0.157	S	C	.	.	S	Bend	trans	-76.3	-10.4	-176.5	31.4	-39.1	0	0	0	113	F59 F76	F59-P165 HydrophobicContact CE1-CG 4.46Å; F59-P165 HydrophobicContact CE2-CG 4.21Å; F59-P165 HydrophobicContact CZ-CG 4.13Å; F76-P165 HydrophobicContact CE1-CG 4.07Å
166	R	95.6	Very high	90.3	Very high	1 Å²	1	24.5 Å²	24.5	0%	0.004	14%	0.139	C	C	.	.	S	Bend	trans	-88.4	148	-178.3	-53.6	175.4	-61.5	-178.1	-0.7	110.4	Y61 F76 D164 W171 L209 E211	Y61-R166 HydrophobicContact CD1-CG 3.97Å; Y61-R166 HydrophobicContact CD2-CG 4.3Å; Y61-R166 HydrophobicContact CG-CG 3.77Å; F76-R166 HydrophobicContact CE1-CG 4.41Å; F76-R166 VanDerWaalsContact CZ-NE 3.28Å; D164-R166 PolarHBondContact O-N 3.01Å; D164-R166 VanDerWaalsContact OD1-CB 3.3Å; D164-R166 WeakPolarHBondContact OD1-CB 3.14Å; D164-R166 WeakPolarHBondContact OD1-CG 3.4Å; D164-R166 PolarHBondContact OD1-N 3.4Å; D164-R166 IonicContact OD1-NE 3.67Å; D164-R166 PolarHBondContact OD1-NE 3.33Å; D164-R166 VanDerWaalsContact OD1-NE 3.14Å; D164-R166 IonicContact OD2-CZ 3.94Å; D164-R166 IonicContact OD2-NE 2.66Å; D164-R166 PolarHBondContact OD2-NE 2.84Å; D164-R166 IonicContact OD2-NH2 2.69Å; D164-R166 PolarHBondContact OD2-NH2 3.36Å; R166-W171 VanDerWaalsContact O-CD1 3.29Å; R166-W171 PolarHBondContact O-NE1 3.13Å; R166-L209 HydrophobicContact CB-CD1 3.8Å; R166-L209 HydrophobicContact CB-CD2 4.01Å; R166-E211 IonicContact CZ-OE2 3.72Å; R166-E211 IonicContact NH1-OE2 3.52Å; R166-E211 PolarHBondContact NH1-OE2 3.28Å; R166-E211 IonicContact NH2-OE2 3.45Å; R166-E211 PolarHBondContact NH2-OE2 3.48Å
167	G	93.6	Very high	91.6	Very high	21 Å²	21	17.5 Å²	17.5	22%	0.216	11%	0.109	C	C	.	.	S	Bend	trans	69.4	-136.2	171.2	0	0	0	0	0	113.6
168	I	91.5	Very high	91.9	Very high	37 Å²	37	17.2 Å²	17.2	19%	0.19	11%	0.111	C	C	.	.	S	Bend	trans	-86	124.7	-176.1	-65.7	178.8	0	0	0	110.8	G170 W171 L207 W381 C395	I168-G170 PolarHBondContact O-N 3.17Å; I168-W171 WeakPolarHBondContact O-CB 3.22Å; I168-W171 PolarHBondContact O-N 2.71Å; I168-W171 VanDerWaalsContact O-N 3.16Å; I168-L207 HydrophobicContact CB-CD2 4.48Å; I168-L207 HydrophobicContact CD1-CD2 3.95Å; I168-L207 HydrophobicContact CG1-CD2 4.01Å; I168-W381 HydrophobicContact CD1-CB 4.06Å; I168-W381 HydrophobicContact CD1-CG 4.49Å; I168-W381 HydrophobicContact CG1-CB 3.57Å; I168-W381 HydrophobicContact CG1-CG 3.9Å; I168-C395 HydrophobicContact CD1-CB 3.26Å; I168-C395 WeakPolarHBondContact CD1-O 3.04Å
169	S	88.7	Confident	91.7	Very high	75 Å²	75	17.3 Å²	17.3	52%	0.524	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.1	124.7	179.9	-169.3	0	0	0	0	113.3	N139	N139-S169 WeakPolarHBondContact CB-OG 3.33Å
170	G	89.4	Confident	91.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	6.6	173.8	0	0	0	0	0	116.4	I168 S172	I168-G170 PolarHBondContact O-N 3.17Å; G170-S172 VanDerWaalsContact C-N 3.29Å; G170-S172 PolarHBondContact O-N 2.82Å
171	W	91	Very high	90.9	Very high	10 Å²	10	26 Å²	26	4%	0.038	16%	0.164	C	C	.	.	S	Bend	trans	-63.4	-33.3	176	77.7	-83.4	0	0	0	113.2	P130 D164 R166 I168 Y200 A203 R204 L207 L209	P130-W171 VanDerWaalsContact CD-O 3.29Å; P130-W171 WeakPolarHBondContact CD-O 3.45Å; D164-W171 HydrophobicContact CB-CZ2 4.23Å; D164-W171 VanDerWaalsContact OD2-CZ2 3.26Å; D164-W171 WeakPolarHBondContact OD2-CZ2 3.43Å; R166-W171 VanDerWaalsContact O-CD1 3.29Å; R166-W171 PolarHBondContact O-NE1 3.13Å; I168-W171 WeakPolarHBondContact O-CB 3.22Å; I168-W171 PolarHBondContact O-N 2.71Å; I168-W171 VanDerWaalsContact O-N 3.16Å; W171-Y200 HydrophobicContact CH2-CD2 4.02Å; W171-Y200 AromaticContact CH2-CE2 3.6Å; W171-Y200 HydrophobicContact CH2-CE2 3.6Å; W171-Y200 HydrophobicContact CZ3-CD2 4.01Å; W171-Y200 HydrophobicContact CZ3-CE2 4.07Å; W171-A203 HydrophobicContact CE3-CB 4.1Å; W171-A203 HydrophobicContact CZ3-CB 3.99Å; W171-R204 HydrophobicContact CH2-CB 4.41Å; W171-R204 HydrophobicContact CH2-CG 3.28Å; W171-R204 HydrophobicContact CZ2-CG 4.1Å; W171-R204 HydrophobicContact CZ3-CG 3.93Å; W171-L207 HydrophobicContact CB-CD1 4.14Å; W171-L207 HydrophobicContact CD2-CD1 3.37Å; W171-L207 HydrophobicContact CE3-CD1 3.8Å; W171-L207 HydrophobicContact CG-CD1 3.55Å; W171-L207 HydrophobicContact CZ2-CD1 4.39Å; W171-L207 HydrophobicContact CZ3-CD1 4.47Å; W171-L209 HydrophobicContact CZ2-CD1 3.92Å
172	S	93.4	Very high	90.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.178	C	C	.	.			trans	-148.7	168.4	171.5	72.9	0	0	0	0	111	A128 D164 G170	A128-S172 CarbonylContact O-C 3.53Å; A128-S172 WeakPolarHBondContact O-CA 3.3Å; A128-S172 WeakPolarHBondContact O-CB 3.37Å; D164-S172 WeakPolarHBondContact CB-OG 3.32Å; D164-S172 PolarHBondContact N-O 2.95Å; D164-S172 PolarHBondContact OD2-OG 3.14Å; G170-S172 VanDerWaalsContact C-N 3.29Å; G170-S172 PolarHBondContact O-N 2.82Å
173	G	92.9	Very high	89.8	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	149.5	177	0	0	0	0	0	111.1	V127 A128 W144 A162	V127-G173 CarbonylContact C-O 3.6Å; V127-G173 WeakPolarHBondContact CA-O 3.32Å; V127-G173 WeakPolarHBondContact CG2-O 3.47Å; A128-G173 PolarHBondContact N-O 2.96Å; A128-G173 PolarHBondContact O-N 3.47Å; W144-G173 VanDerWaalsContact CH2-CA 3.46Å; A162-G173 CarbonylContact O-C 3.57Å; A162-G173 VanDerWaalsContact O-CA 3.29Å; A162-G173 WeakPolarHBondContact O-CA 3.29Å
174	R	94.5	Very high	89.3	Confident	0 Å²	0	29 Å²	29	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142.2	170.7	-72.4	-63.2	-174.1	-78.7	3.1	110.4	F59 Y78 E93 F161 A162 D164 Y200 E211	F59-R174 HydrophobicContact CE2-CB 4.1Å; F59-R174 HydrophobicContact CE2-CG 3.84Å; F59-R174 HydrophobicContact CZ-CB 4.18Å; F59-R174 HydrophobicContact CZ-CG 4.15Å; Y78-R174 HydrophobicContact CE1-CB 4.4Å; E93-R174 IonicContact OE1-NE 3.53Å; F161-R174 CarbonylContact C-O 3.58Å; F161-R174 WeakPolarHBondContact CA-O 3.49Å; A162-R174 PolarHBondContact N-O 2.55Å; A162-R174 PolarHBondContact O-N 2.79Å; D164-R174 IonicContact OD2-CZ 3.94Å; D164-R174 IonicContact OD2-NH1 3.77Å; D164-R174 PolarHBondContact OD2-NH1 2.81Å; D164-R174 IonicContact OD2-NH2 3.5Å; D164-R174 PolarHBondContact OD2-NH2 2.83Å; R174-Y200 PolarHBondContact NH2-OH 3.07Å; R174-E211 IonicContact NH2-OE2 3.61Å; R174-E211 PolarHBondContact NH2-OE2 2.78Å
175	I	94.1	Very high	88.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	131.7	174.3	-59.7	158.6	0	0	0	107.7	I22 W126 A128 W144 L158 F160 F161 V183 F187	I22-I175 HydrophobicContact CD1-CD1 4.23Å; I22-I175 HydrophobicContact CG2-CD1 4.3Å; W126-I175 HydrophobicContact CB-CB 4.04Å; W126-I175 PolarHBondContact N-O 3.06Å; W126-I175 PolarHBondContact O-N 3.45Å; A128-I175 HydrophobicContact CB-CD1 3.88Å; W144-I175 HydrophobicContact CZ3-CD1 4.22Å; W144-I175 HydrophobicContact CZ3-CG1 4.13Å; L158-I175 HydrophobicContact CD1-CG2 3.7Å; F160-I175 CarbonylContact O-C 3.53Å; F160-I175 WeakPolarHBondContact O-CA 3.41Å; F161-I175 HydrophobicContact CB-CG1 4.02Å; I175-V183 HydrophobicContact CD1-CG1 4.43Å; I175-V183 HydrophobicContact CG2-CG1 3.99Å; I175-F187 HydrophobicContact CD1-CD2 4.45Å; I175-F187 HydrophobicContact CD1-CE2 3.49Å; I175-F187 VanDerWaalsContact CD1-CE2 3.49Å; I175-F187 HydrophobicContact CD1-CZ 3.57Å; I175-F187 HydrophobicContact CG1-CE2 4.13Å; I175-F187 HydrophobicContact CG1-CZ 3.78Å; I175-F187 HydrophobicContact CG2-CE2 4.29Å; I175-F187 HydrophobicContact CG2-CZ 4.29Å
176	L	93.8	Very high	88.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128.8	168.5	-56.7	-173.3	0	0	0	108.9	L30 Y78 L91 V123 P125 I159 F160	L30-L176 HydrophobicContact CD1-CD1 4.44Å; L30-L176 HydrophobicContact CD1-CD2 4.08Å; L30-L176 HydrophobicContact CD2-CD1 4.22Å; L30-L176 HydrophobicContact CD2-CD2 4.24Å; Y78-L176 HydrophobicContact CD1-CD1 3.88Å; Y78-L176 HydrophobicContact CD1-CG 4.4Å; Y78-L176 HydrophobicContact CD2-CD1 3.84Å; Y78-L176 HydrophobicContact CE1-CD1 4.1Å; Y78-L176 HydrophobicContact CE1-CD2 4.46Å; Y78-L176 HydrophobicContact CE1-CG 4.19Å; Y78-L176 HydrophobicContact CE2-CD1 4.05Å; Y78-L176 HydrophobicContact CE2-CD2 4.26Å; Y78-L176 HydrophobicContact CG-CD1 3.75Å; L91-L176 HydrophobicContact CD1-CD1 3.77Å; V123-L176 HydrophobicContact CG1-CB 4.07Å; P125-L176 HydrophobicContact CB-CD2 3.99Å; I159-L176 HydrophobicContact CB-CB 4.02Å; I159-L176 HydrophobicContact CG2-CB 4.38Å; I159-L176 PolarHBondContact N-O 3.05Å; F160-L176 HydrophobicContact CB-CB 3.91Å; F160-L176 HydrophobicContact CB-CD1 4.02Å; F160-L176 HydrophobicContact CB-CG 3.92Å; F160-L176 HydrophobicContact CD1-CG 4.5Å; F160-L176 PolarHBondContact N-O 3.2Å; F160-L176 PolarHBondContact O-N 3.39Å
177	S	92.3	Very high	87.7	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	148	-179.1	-176.9	0	0	0	0	111.7	Y124 Q157 S179	Y124-S177 WeakPolarHBondContact CD2-O 3.32Å; Y124-S177 PolarHBondContact N-O 3.23Å; Y124-S177 PolarHBondContact O-N 2.96Å; Q157-S177 CarbonylContact O-C 3.57Å; Q157-S177 VanDerWaalsContact O-CA 3.22Å; Q157-S177 WeakPolarHBondContact O-CA 3.34Å; Q157-S177 PolarHBondContact O-OG 3.27Å; S177-S179 PolarHBondContact OG-N 2.97Å; S177-S179 VanDerWaalsContact OG-N 3.08Å
178	T	90.2	Very high	86.9	Confident	57 Å²	57	30.2 Å²	30.2	35%	0.35	18%	0.183	S	C	.	.	S	Bend	trans	-78.4	-10.3	168.4	63.2	0	0	0	0	112.9	S122 Y124 Q157 I159	S122-T178 WeakPolarHBondContact O-CA 3.5Å; Y124-T178 WeakPolarHBondContact CE2-O 3.34Å; Q157-T178 WeakPolarHBondContact CA-OG1 3.46Å; Q157-T178 PolarHBondContact O-N 2.74Å; I159-T178 HydrophobicContact CD1-CG2 3.73Å; I159-T178 HydrophobicContact CG1-CG2 4.08Å
179	S	84	Confident	86.1	Confident	14 Å²	14	30.5 Å²	30.5	10%	0.098	19%	0.189	C	C	.	.			trans	-88.6	132.6	171.9	176.2	0	0	0	0	110.8	W126 S177 N182	W126-S179 WeakPolarHBondContact CZ2-O 3.37Å; W126-S179 PolarHBondContact NE1-O 3.47Å; S177-S179 PolarHBondContact OG-N 2.97Å; S177-S179 VanDerWaalsContact OG-N 3.08Å; S179-N182 PolarHBondContact OG-N 2.94Å; S179-N182 PolarHBondContact OG-O 3.07Å
180	N	83	Confident	85.8	Confident	74 Å²	74	27.3 Å²	27.3	40%	0.396	17%	0.166	S	C	.	.	S	Bend	trans	-99.5	-7	176.4	61.8	-4.2	0	0	0	114	Q24 Y124 W126	Q24-N180 PolarHBondContact OE1-O 3.03Å; Y124-N180 HydrophobicContact CD1-CB 3.95Å; Y124-N180 HydrophobicContact CD2-CB 3.74Å; Y124-N180 HydrophobicContact CE1-CB 3.85Å; Y124-N180 HydrophobicContact CE2-CB 3.66Å; Y124-N180 HydrophobicContact CG-CB 3.88Å; W126-N180 VanDerWaalsContact CZ2-C 3.49Å; W126-N180 WeakPolarHBondContact CZ2-O 3.28Å
181	T	78	Confident	85.6	Confident	118 Å²	118	31 Å²	31	72%	0.724	19%	0.186	S	C	*	.	S	Bend	trans	-121.2	-33.8	-173.8	48.5	0	0	0	0	114
182	N	77.3	Confident	85.4	Confident	73 Å²	73	32 Å²	32	39%	0.39	19%	0.193	S	C	.	.			trans	-138.9	106.9	-173.8	-168.9	-11	0	0	0	111.3	S179 T184	S179-N182 PolarHBondContact OG-N 2.94Å; S179-N182 PolarHBondContact OG-O 3.07Å; N182-T184 PolarHBondContact OD1-N 2.94Å; N182-T184 PolarHBondContact OD1-OG1 3.02Å
183	V	83.3	Confident	85.2	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.012	22%	0.215	C	C	.	.			trans	-115.3	-9.1	173.1	170.7	0	0	0	0	111	W126 I175 S185 I186 F187	W126-V183 HydrophobicContact CD2-CB 4.34Å; W126-V183 HydrophobicContact CD2-CG2 3.85Å; W126-V183 VanDerWaalsContact CE2-CG2 3.46Å; W126-V183 HydrophobicContact CE3-CB 4.43Å; W126-V183 HydrophobicContact CE3-CG2 4.35Å; W126-V183 HydrophobicContact CG-CG2 4.3Å; W126-V183 HydrophobicContact CH2-CG2 4.21Å; W126-V183 HydrophobicContact CZ2-CG2 3.66Å; I175-V183 HydrophobicContact CD1-CG1 4.43Å; I175-V183 HydrophobicContact CG2-CG1 3.99Å; V183-S185 VanDerWaalsContact C-N 3.33Å; V183-S185 PolarHBondContact O-N 3.27Å; V183-I186 HydrophobicContact CB-CD1 4.43Å; V183-I186 HydrophobicContact CG1-CD1 4.13Å; V183-I186 HydrophobicContact CG2-CD1 4.4Å; V183-I186 VanDerWaalsContact O-CB 3.25Å; V183-I186 WeakPolarHBondContact O-CB 3.31Å; V183-I186 PolarHBondContact O-N 3.01Å; V183-I186 VanDerWaalsContact O-N 3.1Å; V183-F187 HydrophobicContact CG1-CD2 4.28Å; V183-F187 HydrophobicContact CG1-CE2 3.79Å
184	T	81.9	Confident	85.1	Confident	58 Å²	58	42.9 Å²	42.9	36%	0.356	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-65.7	-36.1	-176.9	50.5	0	0	0	0	112.3	N182 I186 F187 T192	N182-T184 PolarHBondContact OD1-N 2.94Å; N182-T184 PolarHBondContact OD1-OG1 3.02Å; T184-I186 PolarHBondContact O-N 2.92Å; T184-F187 PolarHBondContact O-N 3.33Å; T184-F187 VanDerWaalsContact O-N 3.16Å; T184-T192 WeakPolarHBondContact CB-OG1 3.47Å; T184-T192 WeakPolarHBondContact CG2-OG1 3.22Å
185	S	81.2	Confident	84.9	Confident	52 Å²	52	43.7 Å²	43.7	36%	0.364	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-60	-24.3	174.5	56.6	0	0	0	0	113.5	V147 V183 F187	V147-S185 WeakPolarHBondContact CG2-O 3.32Å; V183-S185 VanDerWaalsContact C-N 3.33Å; V183-S185 PolarHBondContact O-N 3.27Å; S185-F187 PolarHBondContact O-N 3.1Å
186	I	83.1	Confident	84.7	Confident	5 Å²	5	47.4 Å²	47.4	3%	0.026	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-70.1	-23.3	-179.5	-55.1	-175.3	0	0	0	111.3	P146 V147 Q157 L158 V183 T184 P188	P146-I186 CarbonylContact C-O 3.5Å; P146-I186 WeakPolarHBondContact CA-O 3.37Å; P146-I186 HydrophobicContact CB-CG2 3.69Å; P146-I186 WeakPolarHBondContact CB-O 3.42Å; V147-I186 WeakPolarHBondContact CG2-O 3.42Å; V147-I186 PolarHBondContact N-O 2.98Å; Q157-I186 HydrophobicContact CB-CD1 4.31Å; L158-I186 HydrophobicContact CB-CD1 4.2Å; L158-I186 HydrophobicContact CB-CG2 4.03Å; L158-I186 HydrophobicContact CD1-CG2 4.22Å; L158-I186 HydrophobicContact CD2-CG2 3.86Å; L158-I186 HydrophobicContact CG-CG2 4.26Å; V183-I186 HydrophobicContact CB-CD1 4.43Å; V183-I186 HydrophobicContact CG1-CD1 4.13Å; V183-I186 HydrophobicContact CG2-CD1 4.4Å; V183-I186 VanDerWaalsContact O-CB 3.25Å; V183-I186 WeakPolarHBondContact O-CB 3.31Å; V183-I186 PolarHBondContact O-N 3.01Å; V183-I186 VanDerWaalsContact O-N 3.1Å; T184-I186 PolarHBondContact O-N 2.92Å; I186-P188 WeakPolarHBondContact O-CD 3.37Å
187	F	85.5	Confident	84.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.288	C	S	.	.			trans	-117.4	64.2	-174.3	-61.8	-83.8	0	0	0	112.8	L20 I22 W144 P146 F161 I175 V183 T184 S185 S189 C190 T192	L20-F187 HydrophobicContact CD2-CB 4.49Å; L20-F187 HydrophobicContact CD2-CG 4.39Å; I22-F187 HydrophobicContact CD1-CD2 3.86Å; I22-F187 HydrophobicContact CD1-CE2 4.3Å; W144-F187 HydrophobicContact CE3-CE1 4.31Å; W144-F187 VanDerWaalsContact O-CD1 3.22Å; W144-F187 WeakPolarHBondContact O-CD1 3.38Å; W144-F187 WeakPolarHBondContact O-CE1 3.26Å; P146-F187 HydrophobicContact CB-CD1 4.36Å; P146-F187 HydrophobicContact CB-CE1 4.17Å; F161-F187 HydrophobicContact CB-CZ 4.39Å; F161-F187 HydrophobicContact CD2-CE1 4.15Å; F161-F187 HydrophobicContact CG-CE1 4.41Å; I175-F187 HydrophobicContact CD1-CD2 4.45Å; I175-F187 HydrophobicContact CD1-CE2 3.49Å; I175-F187 VanDerWaalsContact CD1-CE2 3.49Å; I175-F187 HydrophobicContact CD1-CZ 3.57Å; I175-F187 HydrophobicContact CG1-CE2 4.13Å; I175-F187 HydrophobicContact CG1-CZ 3.78Å; I175-F187 HydrophobicContact CG2-CE2 4.29Å; I175-F187 HydrophobicContact CG2-CZ 4.29Å; V183-F187 HydrophobicContact CG1-CD2 4.28Å; V183-F187 HydrophobicContact CG1-CE2 3.79Å; T184-F187 PolarHBondContact O-N 3.33Å; T184-F187 VanDerWaalsContact O-N 3.16Å; S185-F187 PolarHBondContact O-N 3.1Å; F187-S189 PolarHBondContact O-N 2.96Å; F187-C190 HydrophobicContact CB-CB 4.41Å; F187-C190 PolarHBondContact O-N 3.46Å; F187-T192 HydrophobicContact CB-CG2 4.04Å
188	P	75.5	Confident	84.5	Confident	59 Å²	59	51.8 Å²	51.8	38%	0.383	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.1	-174.1	33.4	-41.1	0	0	0	113.9	K17 V147 I186 C190	K17-P188 WeakPolarHBondContact CE-O 3.26Å; K17-P188 PolarHBondContact NZ-O 2.92Å; V147-P188 HydrophobicContact CB-CG 4.34Å; V147-P188 HydrophobicContact CG1-CG 4.46Å; V147-P188 HydrophobicContact CG2-CG 3.75Å; I186-P188 WeakPolarHBondContact O-CD 3.37Å; P188-C190 PolarHBondContact O-N 3.39Å
189	S	75.5	Confident	84.5	Confident	43 Å²	43	53.7 Å²	53.7	30%	0.301	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.8	171.8	53.5	0	0	0	0	112	S145 F187	S145-S189 PolarHBondContact O-OG 3.31Å; F187-S189 PolarHBondContact O-N 2.96Å
190	C	82.4	Confident	84.9	Confident	8 Å²	8	53 Å²	53	5%	0.054	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	157.7	-179.3	-62.8	0	0	0	0	111.8	R18 L20 F187 P188 T192	R18-C190 CarbonylContact O-C 3.53Å; R18-C190 VanDerWaalsContact O-CA 3.26Å; R18-C190 WeakPolarHBondContact O-CA 3.28Å; R18-C190 WeakPolarHBondContact O-CB 3.41Å; L20-C190 HydrophobicContact CB-CB 3.91Å; L20-C190 HydrophobicContact CD2-CB 4.31Å; F187-C190 HydrophobicContact CB-CB 4.41Å; F187-C190 PolarHBondContact O-N 3.46Å; P188-C190 PolarHBondContact O-N 3.39Å; C190-T192 HydrophobicContact CB-CG2 4.05Å
191	N	84.2	Confident	85.4	Confident	79 Å²	79	50.9 Å²	50.9	42%	0.422	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	98.1	158.5	-175.8	8.6	0	0	0	107.9	K17 R18 L19 L20	K17-N191 HydrophobicContact CB-CB 4.35Å; R18-N191 PolarHBondContact O-N 2.88Å; L19-N191 WeakPolarHBondContact CA-O 3.4Å; L19-N191 HydrophobicContact CD2-CB 3.9Å; L19-N191 WeakPolarHBondContact CD2-ND2 3.4Å; L20-N191 PolarHBondContact N-O 3.48Å
192	T	86.8	Confident	86	Confident	30 Å²	30	46.1 Å²	46.1	18%	0.184	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	137.7	-173.5	56.6	0	0	0	0	112.3	L20 I22 T184 F187 C190	L20-T192 HydrophobicContact CB-CG2 4.48Å; L20-T192 CarbonylContact O-C 3.35Å; L20-T192 WeakPolarHBondContact O-CA 3.22Å; I22-T192 HydrophobicContact CD1-CG2 3.99Å; T184-T192 WeakPolarHBondContact CB-OG1 3.47Å; T184-T192 WeakPolarHBondContact CG2-OG1 3.22Å; F187-T192 HydrophobicContact CB-CG2 4.04Å; C190-T192 HydrophobicContact CB-CG2 4.05Å
193	K	89.1	Confident	86.7	Confident	107 Å²	107	43.5 Å²	43.5	47%	0.465	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	158.4	171.8	-66	-174.3	179.2	-176.8	0	111.2	L20 S21 I22	L20-K193 PolarHBondContact O-N 3.48Å; S21-K193 CarbonylContact C-O 3.56Å; S21-K193 VanDerWaalsContact CA-O 3.27Å; S21-K193 WeakPolarHBondContact CA-O 3.23Å; I22-K193 PolarHBondContact N-O 2.93Å
194	P	90.6	Very high	87.3	Confident	122 Å²	122	43.5 Å²	43.5	79%	0.792	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	136.3	167.1	-22	33.9	0	0	0	111.2
195	L	90.8	Very high	87.9	Confident	16 Å²	16	41 Å²	41	8%	0.084	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-93.7	128.9	171.8	177.7	64.1	0	0	0	110.1	I22 S23 V127 M129 I197 L199	I22-L195 PolarHBondContact O-N 3.43Å; S23-L195 VanDerWaalsContact CB-O 3.24Å; S23-L195 WeakPolarHBondContact CB-O 3.21Å; S23-L195 PolarHBondContact OG-O 3.4Å; V127-L195 HydrophobicContact CG1-CD2 3.89Å; M129-L195 HydrophobicContact CB-CD1 4.29Å; M129-L195 HydrophobicContact CB-CD2 4.1Å; M129-L195 HydrophobicContact CG-CD2 3.82Å; M129-L195 HydrophobicContact SD-CD1 4.05Å; M129-L195 HydrophobicContact SD-CD2 3.81Å; L195-I197 PolarHBondContact O-N 2.88Å; L195-L199 HydrophobicContact CD1-CB 4.2Å; L195-L199 HydrophobicContact CD1-CD1 4.37Å
196	D	89.7	Confident	88.5	Confident	78 Å²	78	41.3 Å²	41.3	42%	0.417	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-66.4	119.4	161.1	176.1	8.6	0	0	0	108.7	N198 L199	D196-N198 PolarHBondContact O-N 3.2Å; D196-N198 VanDerWaalsContact O-N 3.16Å; D196-N198 PolarHBondContact OD1-N 2.88Å; D196-N198 PolarHBondContact OD1-ND2 2.94Å; D196-L199 HydrophobicContact CB-CD1 4.17Å; D196-L199 HydrophobicContact CB-CG 4.17Å; D196-L199 WeakPolarHBondContact O-CB 3.4Å; D196-L199 PolarHBondContact O-N 2.87Å
197	I	91.5	Very high	89	Confident	46 Å²	46	41.6 Å²	41.6	24%	0.236	23%	0.23	C	C	.	.	H	α-helix	trans	-60.9	-26	-176.7	-166.9	63.5	0	0	0	112.6	L25 V127 L195 L199 Y200 H201	L25-I197 HydrophobicContact CD2-CD1 3.6Å; V127-I197 HydrophobicContact CG1-CD1 4.26Å; L195-I197 PolarHBondContact O-N 2.88Å; I197-L199 VanDerWaalsContact C-N 3.27Å; I197-L199 PolarHBondContact O-N 3.36Å; I197-Y200 HydrophobicContact CD1-CD1 3.73Å; I197-Y200 HydrophobicContact CD1-CG 4.32Å; I197-Y200 WeakPolarHBondContact O-CB 3.45Å; I197-Y200 PolarHBondContact O-N 3.15Å; I197-Y200 VanDerWaalsContact O-N 3.12Å; I197-H201 WeakPolarHBondContact CG1-NE2 3.43Å; I197-H201 PolarHBondContact O-CD2 3.3Å; I197-H201 PolarHBondContact O-N 3.28Å
198	N	90.2	Very high	89.6	Confident	46 Å²	46	41.6 Å²	41.6	25%	0.246	23%	0.23	C	C	.	.	H	α-helix	trans	-66.7	-29.9	177.1	-61.3	-66	0	0	0	112.3	D196 Y200 H201 N202 N314	D196-N198 PolarHBondContact O-N 3.2Å; D196-N198 VanDerWaalsContact O-N 3.16Å; D196-N198 PolarHBondContact OD1-N 2.88Å; D196-N198 PolarHBondContact OD1-ND2 2.94Å; N198-Y200 VanDerWaalsContact C-N 3.31Å; N198-Y200 PolarHBondContact O-N 3.05Å; N198-H201 PolarHBondContact O-N 3.37Å; N198-N202 WeakPolarHBondContact O-CB 3.14Å; N198-N202 VanDerWaalsContact O-CG 3.29Å; N198-N202 PolarHBondContact O-N 3Å; N198-N202 PolarHBondContact O-ND2 2.7Å; N198-N314 PolarHBondContact ND2-ND2 3.28Å
199	L	90	Very high	90.6	Very high	97 Å²	97	38.9 Å²	38.9	51%	0.508	21%	0.212	S	C	.	.	H	α-helix	trans	-65.3	-37.4	173.1	-63.2	176.2	0	0	0	111.5	L195 D196 I197 A203	L195-L199 HydrophobicContact CD1-CB 4.2Å; L195-L199 HydrophobicContact CD1-CD1 4.37Å; D196-L199 HydrophobicContact CB-CD1 4.17Å; D196-L199 HydrophobicContact CB-CG 4.17Å; D196-L199 WeakPolarHBondContact O-CB 3.4Å; D196-L199 PolarHBondContact O-N 2.87Å; I197-L199 VanDerWaalsContact C-N 3.27Å; I197-L199 PolarHBondContact O-N 3.36Å; L199-A203 WeakPolarHBondContact O-CB 3.47Å; L199-A203 PolarHBondContact O-N 2.59Å
200	Y	92.5	Very high	91.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.5	-46.3	173.1	162.7	-104.8	0	0	0	112.1	L25 V127 M129 W171 R174 I197 N198 N202 A203 R204 E211	L25-Y200 HydrophobicContact CD2-CD1 4.14Å; L25-Y200 HydrophobicContact CD2-CE1 3.8Å; V127-Y200 HydrophobicContact CB-CD2 4.37Å; V127-Y200 HydrophobicContact CB-CE2 4.4Å; V127-Y200 HydrophobicContact CG1-CD2 4.27Å; V127-Y200 HydrophobicContact CG1-CG 4.18Å; V127-Y200 HydrophobicContact CG2-CD2 3.59Å; V127-Y200 HydrophobicContact CG2-CE2 3.69Å; V127-Y200 HydrophobicContact CG2-CG 4.33Å; M129-Y200 VanDerWaalsContact SD-CA 3.5Å; M129-Y200 HydrophobicContact SD-CD2 4.34Å; W171-Y200 HydrophobicContact CH2-CD2 4.02Å; W171-Y200 AromaticContact CH2-CE2 3.6Å; W171-Y200 HydrophobicContact CH2-CE2 3.6Å; W171-Y200 HydrophobicContact CZ3-CD2 4.01Å; W171-Y200 HydrophobicContact CZ3-CE2 4.07Å; R174-Y200 PolarHBondContact NH2-OH 3.07Å; I197-Y200 HydrophobicContact CD1-CD1 3.73Å; I197-Y200 HydrophobicContact CD1-CG 4.32Å; I197-Y200 WeakPolarHBondContact O-CB 3.45Å; I197-Y200 PolarHBondContact O-N 3.15Å; I197-Y200 VanDerWaalsContact O-N 3.12Å; N198-Y200 VanDerWaalsContact C-N 3.31Å; N198-Y200 PolarHBondContact O-N 3.05Å; Y200-N202 PolarHBondContact O-N 3.07Å; Y200-A203 PolarHBondContact O-N 2.81Å; Y200-R204 HydrophobicContact CD2-CG 4.42Å; Y200-R204 VanDerWaalsContact CE1-NE 3.31Å; Y200-R204 HydrophobicContact CE2-CG 3.94Å; Y200-R204 VanDerWaalsContact CZ-CD 3.47Å; Y200-R204 PolarHBondContact O-N 3.16Å; Y200-R204 VanDerWaalsContact OH-CD 3.3Å; Y200-R204 WeakPolarHBondContact OH-CD 3.16Å; Y200-R204 PolarHBondContact OH-NE 3.14Å; Y200-E211 PolarHBondContact OH-OE1 2.92Å; Y200-E211 PolarHBondContact OH-OE2 2.94Å
201	H	93.4	Very high	92.3	Very high	30 Å²	30	37.1 Å²	37.1	14%	0.139	20%	0.198	C	C	.	.	H	α-helix	trans	-58.4	-47.1	176.1	-64	-46.1	0	0	0	111.7	I197 N198 A203 R204 W205	I197-H201 WeakPolarHBondContact CG1-NE2 3.43Å; I197-H201 PolarHBondContact O-CD2 3.3Å; I197-H201 PolarHBondContact O-N 3.28Å; N198-H201 PolarHBondContact O-N 3.37Å; H201-A203 PolarHBondContact O-N 3.45Å; H201-R204 PolarHBondContact ND1-NH2 3.13Å; H201-R204 WeakPolarHBondContact O-CB 3.5Å; H201-R204 PolarHBondContact O-N 3.39Å; H201-W205 HydrophobicContact CB-CH2 4.12Å; H201-W205 HydrophobicContact CB-CZ2 3.9Å; H201-W205 VanDerWaalsContact O-CD2 3.3Å; H201-W205 PolarHBondContact O-N 3.01Å
202	N	91.6	Very high	92.7	Very high	18 Å²	18	33.4 Å²	33.4	10%	0.096	18%	0.179	C	C	.	.	H	α-helix	trans	-59.7	-46.8	176.2	-76.5	-40.8	0	0	0	112.6	N198 Y200 R204 W205 E206 N312 S337	N198-N202 WeakPolarHBondContact O-CB 3.14Å; N198-N202 VanDerWaalsContact O-CG 3.29Å; N198-N202 PolarHBondContact O-N 3Å; N198-N202 PolarHBondContact O-ND2 2.7Å; Y200-N202 PolarHBondContact O-N 3.07Å; N202-R204 VanDerWaalsContact C-N 3.31Å; N202-R204 PolarHBondContact O-N 2.81Å; N202-W205 PolarHBondContact O-N 3.12Å; N202-W205 VanDerWaalsContact O-N 3.16Å; N202-W205 WeakPolarHBondContact OD1-CZ3 3.49Å; N202-E206 WeakPolarHBondContact O-CB 3.49Å; N202-E206 WeakPolarHBondContact O-CG 3.33Å; N202-E206 PolarHBondContact O-N 3.16Å; N202-N312 PolarHBondContact ND2-ND2 3.25Å; N202-N312 WeakPolarHBondContact OD1-CB 3.47Å; N202-S337 PolarHBondContact OD1-OG 3.37Å
203	A	92	Very high	92.9	Very high	17 Å²	17	34.5 Å²	34.5	14%	0.14	18%	0.184	C	C	.	.	H	α-helix	trans	-60.7	-40.8	178.9	0	0	0	0	0	111.8	M129 W171 L199 Y200 H201 E206 L207	M129-A203 HydrophobicContact CE-CB 3.63Å; W171-A203 HydrophobicContact CE3-CB 4.1Å; W171-A203 HydrophobicContact CZ3-CB 3.99Å; L199-A203 WeakPolarHBondContact O-CB 3.47Å; L199-A203 PolarHBondContact O-N 2.59Å; Y200-A203 PolarHBondContact O-N 2.81Å; H201-A203 PolarHBondContact O-N 3.45Å; A203-E206 PolarHBondContact O-N 3.4Å; A203-L207 WeakPolarHBondContact O-CG 3.35Å; A203-L207 PolarHBondContact O-N 2.87Å; A203-L207 VanDerWaalsContact O-N 3.15Å
204	R	95.2	Very high	92.8	Very high	3 Å²	3	35.2 Å²	35.2	1%	0.011	19%	0.187	C	C	.	.	H	α-helix	trans	-60	-46.9	172.6	-79	-164	-64.7	98	-10.2	112.5	W171 Y200 H201 N202 L207 G208 L209 E211 E215	W171-R204 HydrophobicContact CH2-CB 4.41Å; W171-R204 HydrophobicContact CH2-CG 3.28Å; W171-R204 HydrophobicContact CZ2-CG 4.1Å; W171-R204 HydrophobicContact CZ3-CG 3.93Å; Y200-R204 HydrophobicContact CD2-CG 4.42Å; Y200-R204 VanDerWaalsContact CE1-NE 3.31Å; Y200-R204 HydrophobicContact CE2-CG 3.94Å; Y200-R204 VanDerWaalsContact CZ-CD 3.47Å; Y200-R204 PolarHBondContact O-N 3.16Å; Y200-R204 VanDerWaalsContact OH-CD 3.3Å; Y200-R204 WeakPolarHBondContact OH-CD 3.16Å; Y200-R204 PolarHBondContact OH-NE 3.14Å; H201-R204 PolarHBondContact ND1-NH2 3.13Å; H201-R204 WeakPolarHBondContact O-CB 3.5Å; H201-R204 PolarHBondContact O-N 3.39Å; N202-R204 VanDerWaalsContact C-N 3.31Å; N202-R204 PolarHBondContact O-N 2.81Å; R204-L207 CarbonylContact O-C 3.56Å; R204-L207 WeakPolarHBondContact O-CA 3.45Å; R204-L207 WeakPolarHBondContact O-CB 3.25Å; R204-L207 PolarHBondContact O-N 2.79Å; R204-L207 VanDerWaalsContact O-N 3.11Å; R204-G208 PolarHBondContact O-N 3.2Å; R204-G208 VanDerWaalsContact O-N 3.09Å; R204-L209 HydrophobicContact CB-CB 4.25Å; R204-L209 PolarHBondContact NH1-O 3.4Å; R204-L209 WeakPolarHBondContact O-CB 3.5Å; R204-L209 PolarHBondContact O-N 2.93Å; R204-E211 WeakPolarHBondContact CD-OE2 3.36Å; R204-E211 IonicContact CZ-OE1 3.64Å; R204-E211 IonicContact NE-OE1 3.05Å; R204-E211 PolarHBondContact NE-OE1 2.95Å; R204-E211 IonicContact NE-OE2 2.86Å; R204-E211 IonicContact NH2-OE1 3.06Å; R204-E215 IonicContact CZ-OE1 3.5Å; R204-E215 IonicContact NH1-OE1 3.47Å; R204-E215 PolarHBondContact NH1-OE1 3.1Å; R204-E215 IonicContact NH1-OE2 3.14Å; R204-E215 PolarHBondContact NH1-OE2 3.19Å; R204-E215 IonicContact NH2-OE1 2.8Å; R204-E215 PolarHBondContact NH2-OE1 3.5Å
205	W	95.2	Very high	93	Very high	6 Å²	6	29.6 Å²	29.6	2%	0.023	15%	0.15	C	C	.	.	H	α-helix	trans	-67	-38.9	-178.9	-58.3	-24.2	0	0	0	111.9	H201 N202 L207 G208 E215 P262 N310 V311 N312 I339	H201-W205 HydrophobicContact CB-CH2 4.12Å; H201-W205 HydrophobicContact CB-CZ2 3.9Å; H201-W205 VanDerWaalsContact O-CD2 3.3Å; H201-W205 PolarHBondContact O-N 3.01Å; N202-W205 PolarHBondContact O-N 3.12Å; N202-W205 VanDerWaalsContact O-N 3.16Å; N202-W205 WeakPolarHBondContact OD1-CZ3 3.49Å; W205-L207 PolarHBondContact O-N 2.92Å; W205-G208 PolarHBondContact O-N 3.08Å; W205-E215 PolarHBondContact NE1-OE1 3.48Å; W205-E215 PolarHBondContact NE1-OE2 2.93Å; W205-P262 WeakPolarHBondContact O-CB 3.31Å; W205-P262 WeakPolarHBondContact O-CG 3.43Å; W205-N310 HydrophobicContact CH2-CB 4.28Å; W205-N310 HydrophobicContact CZ2-CB 3.66Å; W205-N310 VanDerWaalsContact CZ2-CG 3.44Å; W205-V311 VanDerWaalsContact CZ3-C 3.47Å; W205-N312 HydrophobicContact CH2-CB 4.45Å; W205-N312 HydrophobicContact CZ3-CB 3.7Å; W205-I339 HydrophobicContact CB-CB 4.13Å; W205-I339 HydrophobicContact CG-CB 3.88Å; W205-I339 HydrophobicContact CG-CG2 4.11Å
206	E	93.2	Very high	93.2	Very high	58 Å²	58	29.3 Å²	29.3	27%	0.271	15%	0.148	S	C	.	.	H	α-helix	trans	-58.1	-28.8	171.5	-75.2	-175.8	167.8	0	0	111.9	R133 N202 A203 P379	R133-E206 IonicContact CZ-OE1 3.69Å; R133-E206 IonicContact NH2-OE1 3.42Å; R133-E206 PolarHBondContact NH2-OE1 2.91Å; R133-E206 IonicContact NH2-OE2 3Å; R133-E206 PolarHBondContact NH2-OE2 2.8Å; N202-E206 WeakPolarHBondContact O-CB 3.49Å; N202-E206 WeakPolarHBondContact O-CG 3.33Å; N202-E206 PolarHBondContact O-N 3.16Å; A203-E206 PolarHBondContact O-N 3.4Å; E206-P379 WeakPolarHBondContact O-CG 3.42Å
207	L	95.1	Very high	93	Very high	10 Å²	10	27.4 Å²	27.4	5%	0.052	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.8	173.9	-65.6	173.1	0	0	0	114	I168 W171 A203 R204 W205 L209 P379 W381 W382 C395	I168-L207 HydrophobicContact CB-CD2 4.48Å; I168-L207 HydrophobicContact CD1-CD2 3.95Å; I168-L207 HydrophobicContact CG1-CD2 4.01Å; W171-L207 HydrophobicContact CB-CD1 4.14Å; W171-L207 HydrophobicContact CD2-CD1 3.37Å; W171-L207 HydrophobicContact CE3-CD1 3.8Å; W171-L207 HydrophobicContact CG-CD1 3.55Å; W171-L207 HydrophobicContact CZ2-CD1 4.39Å; W171-L207 HydrophobicContact CZ3-CD1 4.47Å; A203-L207 WeakPolarHBondContact O-CG 3.35Å; A203-L207 PolarHBondContact O-N 2.87Å; A203-L207 VanDerWaalsContact O-N 3.15Å; R204-L207 CarbonylContact O-C 3.56Å; R204-L207 WeakPolarHBondContact O-CA 3.45Å; R204-L207 WeakPolarHBondContact O-CB 3.25Å; R204-L207 PolarHBondContact O-N 2.79Å; R204-L207 VanDerWaalsContact O-N 3.11Å; W205-L207 PolarHBondContact O-N 2.92Å; L207-L209 HydrophobicContact CB-CD1 3.89Å; L207-L209 HydrophobicContact CB-CG 3.89Å; L207-L209 HydrophobicContact CD1-CD1 4.08Å; L207-P379 VanDerWaalsContact C-CG 3.47Å; L207-P379 WeakPolarHBondContact O-CG 3.4Å; L207-W381 WeakPolarHBondContact O-CZ2 3.4Å; L207-W381 PolarHBondContact O-NE1 2.87Å; L207-W382 PolarHBondContact O-NE1 2.9Å; L207-C395 HydrophobicContact CD2-CB 3.87Å
208	G	96.6	Very high	92.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	31.5	-176.7	0	0	0	0	0	113.6	R204 W205 P210 N227	R204-G208 PolarHBondContact O-N 3.2Å; R204-G208 VanDerWaalsContact O-N 3.09Å; W205-G208 PolarHBondContact O-N 3.08Å; G208-P210 WeakPolarHBondContact O-CD 3.42Å; G208-N227 PolarHBondContact O-ND2 3.11Å
209	L	97.1	Very high	91.7	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.016	16%	0.156	C	C	.	.			trans	-103	96.1	-177.2	-61.6	176.6	0	0	0	111	R166 W171 R204 L207 W381	R166-L209 HydrophobicContact CB-CD1 3.8Å; R166-L209 HydrophobicContact CB-CD2 4.01Å; W171-L209 HydrophobicContact CZ2-CD1 3.92Å; R204-L209 HydrophobicContact CB-CB 4.25Å; R204-L209 PolarHBondContact NH1-O 3.4Å; R204-L209 WeakPolarHBondContact O-CB 3.5Å; R204-L209 PolarHBondContact O-N 2.93Å; L207-L209 HydrophobicContact CB-CD1 3.89Å; L207-L209 HydrophobicContact CB-CG 3.89Å; L207-L209 HydrophobicContact CD1-CD1 4.08Å; L209-W381 HydrophobicContact CD2-CH2 4.4Å; L209-W381 HydrophobicContact CD2-CZ2 3.98Å
210	P	96.8	Very high	91.8	Very high	2 Å²	2	29 Å²	29	1%	0.013	15%	0.154	C	C	.	.			trans	-70.4	150.9	171.4	31.3	-35.9	0	0	0	111.5	G208 E215 F216 Y260 I339	G208-P210 WeakPolarHBondContact O-CD 3.42Å; P210-E215 WeakPolarHBondContact CA-OE2 3.32Å; P210-E215 HydrophobicContact CB-CB 4.28Å; P210-F216 HydrophobicContact CB-CD1 4.34Å; P210-F216 HydrophobicContact CB-CE1 3.66Å; P210-F216 HydrophobicContact CB-CZ 3.82Å; P210-F216 HydrophobicContact CG-CD1 4.48Å; P210-F216 HydrophobicContact CG-CE1 3.48Å; P210-F216 VanDerWaalsContact CG-CE1 3.48Å; P210-F216 HydrophobicContact CG-CZ 3.73Å; P210-Y260 HydrophobicContact CB-CD1 3.79Å; P210-Y260 HydrophobicContact CB-CD2 4.45Å; P210-Y260 HydrophobicContact CB-CE1 4.19Å; P210-Y260 HydrophobicContact CB-CG 3.93Å; P210-Y260 HydrophobicContact CG-CD1 4.18Å; P210-Y260 HydrophobicContact CG-CD2 4.06Å; P210-Y260 HydrophobicContact CG-CG 3.78Å; P210-I339 HydrophobicContact CB-CD1 4Å
211	E	95.9	Very high	92	Very high	11 Å²	11	29 Å²	29	5%	0.051	15%	0.154	C	C	.	.			trans	-153.5	131.1	-175.9	179.1	167.3	111.3	0	0	111.4	R28 R166 R174 Y200 R204 E215	R28-E211 IonicContact NH1-OE1 3.89Å; R166-E211 IonicContact CZ-OE2 3.72Å; R166-E211 IonicContact NH1-OE2 3.52Å; R166-E211 PolarHBondContact NH1-OE2 3.28Å; R166-E211 IonicContact NH2-OE2 3.45Å; R166-E211 PolarHBondContact NH2-OE2 3.48Å; R174-E211 IonicContact NH2-OE2 3.61Å; R174-E211 PolarHBondContact NH2-OE2 2.78Å; Y200-E211 PolarHBondContact OH-OE1 2.92Å; Y200-E211 PolarHBondContact OH-OE2 2.94Å; R204-E211 WeakPolarHBondContact CD-OE2 3.36Å; R204-E211 IonicContact CZ-OE1 3.64Å; R204-E211 IonicContact NE-OE1 3.05Å; R204-E211 PolarHBondContact NE-OE1 2.95Å; R204-E211 IonicContact NE-OE2 2.86Å; R204-E211 IonicContact NH2-OE1 3.06Å; E211-E215 PolarHBondContact N-OE2 3.4Å; E211-E215 VanDerWaalsContact O-CD 3.27Å; E211-E215 WeakPolarHBondContact O-CG 3.48Å
212	G	93.7	Very high	92.1	Very high	2 Å²	2	28.9 Å²	28.9	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	75.7	174.8	175.9	0	0	0	0	0	115.9	D74 D95 K214 E215 F216	D74-G212 WeakPolarHBondContact OD1-CA 3.37Å; D74-G212 PolarHBondContact OD1-N 3.33Å; D95-G212 WeakPolarHBondContact OD2-CA 3.29Å; G212-K214 VanDerWaalsContact C-N 3.33Å; G212-K214 PolarHBondContact O-N 3.37Å; G212-E215 PolarHBondContact O-N 2.87Å; G212-F216 WeakPolarHBondContact O-CD2 3.48Å; G212-F216 PolarHBondContact O-N 3.27Å; G212-F216 VanDerWaalsContact O-N 3.08Å
213	I	90.1	Very high	92.4	Very high	53 Å²	53	28 Å²	28	27%	0.272	15%	0.15	S	C	.	.	H	α-helix	trans	-73.3	-24.9	-168.1	-159.5	166	0	0	0	113.4	D95 S97 E215 F216 T218	D95-I213 PolarHBondContact OD2-N 2.72Å; S97-I213 WeakPolarHBondContact OG-CG2 3.48Å; I213-E215 VanDerWaalsContact C-N 3.28Å; I213-F216 VanDerWaalsContact O-O 3.06Å; I213-T218 HydrophobicContact CD1-CG2 4.2Å; I213-T218 VanDerWaalsContact CG1-OG1 3.23Å; I213-T218 WeakPolarHBondContact CG1-OG1 3.33Å
214	K	88.8	Confident	92.6	Very high	122 Å²	122	27.7 Å²	27.7	53%	0.53	15%	0.145	S	C	.	.	H	α-helix	trans	-66.9	-35.8	177	-65.1	176.4	-176.2	169.5	0	110.7	E27 G212 R309	E27-K214 IonicContact OE1-NZ 2.88Å; E27-K214 PolarHBondContact OE1-NZ 3.23Å; E27-K214 IonicContact OE2-NZ 3.97Å; G212-K214 VanDerWaalsContact C-N 3.33Å; G212-K214 PolarHBondContact O-N 3.37Å; K214-R309 PolarHBondContact O-NH2 3.03Å
215	E	94.7	Very high	92.7	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.019	15%	0.15	C	C	.	.	H	α-helix	trans	-86.9	-43.1	-177.6	-60.1	-178	-169.3	0	0	110.9	R204 W205 P210 E211 G212 I213 Y260 R309 N310	R204-E215 IonicContact CZ-OE1 3.5Å; R204-E215 IonicContact NH1-OE1 3.47Å; R204-E215 PolarHBondContact NH1-OE1 3.1Å; R204-E215 IonicContact NH1-OE2 3.14Å; R204-E215 PolarHBondContact NH1-OE2 3.19Å; R204-E215 IonicContact NH2-OE1 2.8Å; R204-E215 PolarHBondContact NH2-OE1 3.5Å; W205-E215 PolarHBondContact NE1-OE1 3.48Å; W205-E215 PolarHBondContact NE1-OE2 2.93Å; P210-E215 WeakPolarHBondContact CA-OE2 3.32Å; P210-E215 HydrophobicContact CB-CB 4.28Å; E211-E215 PolarHBondContact N-OE2 3.4Å; E211-E215 VanDerWaalsContact O-CD 3.27Å; E211-E215 WeakPolarHBondContact O-CG 3.48Å; G212-E215 PolarHBondContact O-N 2.87Å; I213-E215 VanDerWaalsContact C-N 3.28Å; E215-Y260 WeakPolarHBondContact O-CE1 3.27Å; E215-Y260 PolarHBondContact O-OH 3.47Å; E215-Y260 VanDerWaalsContact O-OH 3.06Å; E215-R309 PolarHBondContact O-NE 3.49Å; E215-R309 PolarHBondContact O-NH2 2.86Å; E215-N310 HydrophobicContact CG-CB 4.02Å
216	F	93.2	Very high	92.7	Very high	9 Å²	9	28.5 Å²	28.5	4%	0.039	15%	0.15	C	C	.	.	S	Bend	trans	-72.1	144.2	177.3	-67.4	-58.4	0	0	0	113.8	D74 P210 G212 I213 T218 T221 A226 Y260 R309	D74-F216 HydrophobicContact CB-CE2 3.59Å; D74-F216 HydrophobicContact CB-CZ 4.09Å; D74-F216 WeakPolarHBondContact OD1-CE2 3.37Å; P210-F216 HydrophobicContact CB-CD1 4.34Å; P210-F216 HydrophobicContact CB-CE1 3.66Å; P210-F216 HydrophobicContact CB-CZ 3.82Å; P210-F216 HydrophobicContact CG-CD1 4.48Å; P210-F216 HydrophobicContact CG-CE1 3.48Å; P210-F216 VanDerWaalsContact CG-CE1 3.48Å; P210-F216 HydrophobicContact CG-CZ 3.73Å; G212-F216 WeakPolarHBondContact O-CD2 3.48Å; G212-F216 PolarHBondContact O-N 3.27Å; G212-F216 VanDerWaalsContact O-N 3.08Å; I213-F216 VanDerWaalsContact O-O 3.06Å; F216-T218 PolarHBondContact O-N 2.86Å; F216-T221 HydrophobicContact CD1-CG2 3.92Å; F216-T221 HydrophobicContact CE1-CG2 4.48Å; F216-A226 HydrophobicContact CD1-CB 4.31Å; F216-A226 HydrophobicContact CE1-CB 3.47Å; F216-A226 VanDerWaalsContact CE1-CB 3.47Å; F216-A226 HydrophobicContact CZ-CB 4.2Å; F216-Y260 VanDerWaalsContact CA-OH 3.3Å; F216-Y260 WeakPolarHBondContact CA-OH 3.17Å; F216-Y260 HydrophobicContact CD1-CE2 4.15Å; F216-Y260 HydrophobicContact CE1-CE2 4.46Å; F216-R309 PolarHBondContact O-NH2 2.81Å
217	I	87.3	Confident	92.9	Very high	39 Å²	39	25.8 Å²	25.8	20%	0.2	14%	0.137	C	C	.	.			trans	-76.6	102.7	162.3	-54.7	177.5	0	0	0	106.9	S219 D220 T221 Y260 L341	I217-S219 PolarHBondContact O-N 3.07Å; I217-D220 HydrophobicContact CB-CB 4.36Å; I217-D220 HydrophobicContact CG2-CB 3.7Å; I217-D220 PolarHBondContact O-N 2.82Å; I217-D220 VanDerWaalsContact O-N 3.14Å; I217-T221 WeakPolarHBondContact CA-OG1 3.47Å; I217-T221 PolarHBondContact N-OG1 3.09Å; I217-T221 PolarHBondContact O-N 2.89Å; I217-T221 PolarHBondContact O-OG1 3.05Å; I217-Y260 PolarHBondContact N-OH 3.36Å; I217-L341 HydrophobicContact CD1-CD2 3.47Å; I217-L341 VanDerWaalsContact CD1-CD2 3.47Å; I217-L341 HydrophobicContact CG1-CD2 4.37Å
218	T	75.3	Confident	93.1	Very high	77 Å²	77	25.3 Å²	25.3	47%	0.472	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	125.5	-175.5	-54.4	0	0	0	0	111.9	I213 F216 D220	I213-T218 HydrophobicContact CD1-CG2 4.2Å; I213-T218 VanDerWaalsContact CG1-OG1 3.23Å; I213-T218 WeakPolarHBondContact CG1-OG1 3.33Å; F216-T218 PolarHBondContact O-N 2.86Å; T218-D220 PolarHBondContact O-N 2.79Å
219	S	78.8	Confident	93	Very high	57 Å²	57	27.2 Å²	27.2	40%	0.399	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	10.7	176.8	-61.3	0	0	0	0	116.4	R70 V71 I217	R70-S219 WeakPolarHBondContact CB-O 3.34Å; R70-S219 VanDerWaalsContact CG-O 3.26Å; R70-S219 WeakPolarHBondContact CG-O 3.49Å; V71-S219 PolarHBondContact O-N 3.07Å; I217-S219 PolarHBondContact O-N 3.07Å
220	D	92	Very high	93	Very high	87 Å²	87	28.5 Å²	28.5	47%	0.465	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-28.2	175.9	-162.6	40.9	0	0	0	112.8	R70 I217 T218 L222	R70-D220 WeakPolarHBondContact CD-O 3.43Å; I217-D220 HydrophobicContact CB-CB 4.36Å; I217-D220 HydrophobicContact CG2-CB 3.7Å; I217-D220 PolarHBondContact O-N 2.82Å; I217-D220 VanDerWaalsContact O-N 3.14Å; T218-D220 PolarHBondContact O-N 2.79Å; D220-L222 PolarHBondContact O-N 2.86Å
221	T	95.5	Very high	93	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.152	C	C	.	.			trans	-60	136	179.5	-57	0	0	0	0	112	R70 V71 F216 I217 E225 A226 Y260	R70-T221 WeakPolarHBondContact CA-O 3.49Å; V71-T221 HydrophobicContact CG2-CG2 4.2Å; V71-T221 WeakPolarHBondContact CG2-O 3.24Å; V71-T221 PolarHBondContact N-O 2.99Å; F216-T221 HydrophobicContact CD1-CG2 3.92Å; F216-T221 HydrophobicContact CE1-CG2 4.48Å; I217-T221 WeakPolarHBondContact CA-OG1 3.47Å; I217-T221 PolarHBondContact N-OG1 3.09Å; I217-T221 PolarHBondContact O-N 2.89Å; I217-T221 PolarHBondContact O-OG1 3.05Å; T221-E225 HydrophobicContact CG2-CB 4.22Å; T221-A226 HydrophobicContact CG2-CB 4.07Å; T221-Y260 HydrophobicContact CG2-CE2 3.75Å; T221-Y260 PolarHBondContact OG1-OH 2.89Å
222	L	96.4	Very high	93	Very high	28 Å²	28	30.1 Å²	30.1	15%	0.147	17%	0.17	C	C	.	.			trans	-86.3	149.5	168.3	-75.5	168.9	0	0	0	112.5	D220 F224 E225 A226 L246	D220-L222 PolarHBondContact O-N 2.86Å; L222-F224 VanDerWaalsContact C-N 3.27Å; L222-F224 PolarHBondContact O-N 3.47Å; L222-E225 HydrophobicContact CB-CB 4.13Å; L222-E225 HydrophobicContact CB-CG 3.88Å; L222-E225 HydrophobicContact CD1-CG 4.45Å; L222-E225 PolarHBondContact N-OE2 2.69Å; L222-E225 WeakPolarHBondContact O-CB 3.46Å; L222-E225 PolarHBondContact O-N 3.2Å; L222-A226 PolarHBondContact O-N 3.13Å; L222-L246 HydrophobicContact CD2-CD2 3.48Å; L222-L246 VanDerWaalsContact CD2-CD2 3.48Å; L222-L246 HydrophobicContact CD2-CG 3.73Å
223	P	97.3	Very high	93.2	Very high	1 Å²	1	30 Å²	30	1%	0.006	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-41.7	172.5	-32.9	40.9	0	0	0	114.4	L63 L65 V71 A226 N227 A228 V234 T247	L63-P223 HydrophobicContact CD1-CB 3.69Å; L63-P223 HydrophobicContact CD1-CG 4Å; L65-P223 HydrophobicContact CD1-CG 4.04Å; L65-P223 HydrophobicContact CD2-CG 3.76Å; V71-P223 HydrophobicContact CG2-CG 4.34Å; P223-A226 CarbonylContact O-C 3.53Å; P223-A226 WeakPolarHBondContact O-CB 3.26Å; P223-A226 PolarHBondContact O-N 2.78Å; P223-N227 PolarHBondContact O-N 3.5Å; P223-A228 HydrophobicContact CB-CB 4.29Å; P223-A228 VanDerWaalsContact O-CB 3.24Å; P223-A228 WeakPolarHBondContact O-CB 3.35Å; P223-A228 PolarHBondContact O-N 2.76Å; P223-V234 HydrophobicContact CB-CG2 4.11Å; P223-T247 HydrophobicContact CB-CG2 4.27Å; P223-T247 HydrophobicContact CG-CG2 4.38Å
224	F	96.7	Very high	93.5	Very high	9 Å²	9	28 Å²	28	4%	0.039	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-30.5	177.5	-80.7	-97.7	0	0	0	113	L222 A226 N227 D229 F236 T247 T250 H251 I256 R259	L222-F224 VanDerWaalsContact C-N 3.27Å; L222-F224 PolarHBondContact O-N 3.47Å; F224-A226 VanDerWaalsContact C-N 3.31Å; F224-N227 PolarHBondContact O-N 2.95Å; F224-D229 HydrophobicContact CD1-CB 3.7Å; F224-D229 WeakPolarHBondContact CD1-OD2 3.46Å; F224-D229 HydrophobicContact CE1-CB 3.48Å; F224-D229 VanDerWaalsContact CE1-CB 3.48Å; F224-D229 HydrophobicContact CG-CB 4.44Å; F224-D229 HydrophobicContact CZ-CB 4.03Å; F224-F236 HydrophobicContact CE1-CZ 4.39Å; F224-F236 HydrophobicContact CE2-CE1 4.09Å; F224-F236 HydrophobicContact CE2-CZ 4.06Å; F224-F236 AromaticContact CZ-CE1 3.81Å; F224-F236 HydrophobicContact CZ-CE1 3.81Å; F224-F236 AromaticContact CZ-CZ 3.51Å; F224-F236 HydrophobicContact CZ-CZ 3.51Å; F224-T247 HydrophobicContact CD2-CG2 4.28Å; F224-T247 HydrophobicContact CE2-CG2 3.84Å; F224-T250 HydrophobicContact CB-CG2 4.07Å; F224-T250 HydrophobicContact CD1-CG2 4.33Å; F224-T250 HydrophobicContact CD2-CG2 3.76Å; F224-T250 HydrophobicContact CE2-CG2 4.26Å; F224-T250 HydrophobicContact CG-CG2 3.79Å; F224-H251 HydrophobicContact CE2-CB 4.18Å; F224-H251 HydrophobicContact CZ-CB 3.71Å; F224-I256 HydrophobicContact CB-CG1 3.86Å; F224-I256 HydrophobicContact CB-CG2 4.25Å; F224-I256 HydrophobicContact CD1-CD1 3.86Å; F224-I256 HydrophobicContact CD1-CG1 3.57Å; F224-I256 HydrophobicContact CE1-CD1 4.24Å; F224-I256 HydrophobicContact CE1-CG1 4.42Å; F224-I256 HydrophobicContact CG-CG1 4.01Å; F224-R259 PolarHBondContact O-NH1 3.31Å
225	E	96.8	Very high	94	Very high	26 Å²	26	23 Å²	23	12%	0.121	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-44.5	171.7	-72.9	172.1	157.1	0	0	109.3	T221 L222 N227 R258 R259 Y260 L341	T221-E225 HydrophobicContact CG2-CB 4.22Å; L222-E225 HydrophobicContact CB-CB 4.13Å; L222-E225 HydrophobicContact CB-CG 3.88Å; L222-E225 HydrophobicContact CD1-CG 4.45Å; L222-E225 PolarHBondContact N-OE2 2.69Å; L222-E225 WeakPolarHBondContact O-CB 3.46Å; L222-E225 PolarHBondContact O-N 3.2Å; E225-N227 PolarHBondContact O-N 3.05Å; E225-R258 HydrophobicContact CG-CB 4.03Å; E225-R258 WeakPolarHBondContact CG-O 3.26Å; E225-R259 WeakPolarHBondContact O-CA 3.34Å; E225-Y260 VanDerWaalsContact O-CD2 3.28Å; E225-Y260 WeakPolarHBondContact O-CD2 3.01Å; E225-Y260 PolarHBondContact O-N 2.93Å; E225-L341 HydrophobicContact CB-CD1 3.98Å; E225-L341 HydrophobicContact CG-CD1 4.22Å
226	A	96.6	Very high	94	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.008	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	4	175.7	0	0	0	0	0	115	F216 T221 L222 P223 F224 A228	F216-A226 HydrophobicContact CD1-CB 4.31Å; F216-A226 HydrophobicContact CE1-CB 3.47Å; F216-A226 VanDerWaalsContact CE1-CB 3.47Å; F216-A226 HydrophobicContact CZ-CB 4.2Å; T221-A226 HydrophobicContact CG2-CB 4.07Å; L222-A226 PolarHBondContact O-N 3.13Å; P223-A226 CarbonylContact O-C 3.53Å; P223-A226 WeakPolarHBondContact O-CB 3.26Å; P223-A226 PolarHBondContact O-N 2.78Å; F224-A226 VanDerWaalsContact C-N 3.31Å; A226-A228 PolarHBondContact O-N 2.83Å
227	N	97.5	Very high	94	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	25.4	-176.5	-53.8	-44.1	0	0	0	114.3	G208 P223 F224 E225 D229 L230 S231 R259 Y260 W382	G208-N227 PolarHBondContact O-ND2 3.11Å; P223-N227 PolarHBondContact O-N 3.5Å; F224-N227 PolarHBondContact O-N 2.95Å; E225-N227 PolarHBondContact O-N 3.05Å; N227-D229 PolarHBondContact O-N 3.46Å; N227-L230 HydrophobicContact CB-CB 4.39Å; N227-L230 HydrophobicContact CB-CD1 4.27Å; N227-L230 HydrophobicContact CB-CG 4.42Å; N227-L230 PolarHBondContact O-N 2.76Å; N227-S231 PolarHBondContact O-N 3.27Å; N227-S231 PolarHBondContact O-OG 3.4Å; N227-R259 WeakPolarHBondContact OD1-CD 3.27Å; N227-R259 WeakPolarHBondContact OD1-CG 3.35Å; N227-R259 PolarHBondContact OD1-NH1 2.98Å; N227-Y260 PolarHBondContact ND2-O 2.8Å; N227-W382 HydrophobicContact CB-CZ2 4.45Å; N227-W382 VanDerWaalsContact ND2-CZ2 3.27Å; N227-W382 WeakPolarHBondContact ND2-CZ2 3.21Å; N227-W382 WeakPolarHBondContact OD1-CH2 3.18Å
228	A	97.5	Very high	94.5	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-20	-178.6	0	0	0	0	0	113.1	L63 P223 A226 S231 G233 V234	L63-A228 HydrophobicContact CD1-CB 3.52Å; L63-A228 HydrophobicContact CG-CB 4.2Å; P223-A228 HydrophobicContact CB-CB 4.29Å; P223-A228 VanDerWaalsContact O-CB 3.24Å; P223-A228 WeakPolarHBondContact O-CB 3.35Å; P223-A228 PolarHBondContact O-N 2.76Å; A226-A228 PolarHBondContact O-N 2.83Å; A228-S231 WeakPolarHBondContact CA-OG 3.5Å; A228-G233 CarbonylContact O-C 3.51Å; A228-G233 WeakPolarHBondContact O-CA 3.49Å; A228-G233 PolarHBondContact O-N 3.39Å; A228-V234 HydrophobicContact CB-CG2 3.75Å; A228-V234 PolarHBondContact O-N 2.58Å
229	D	96.2	Very high	95.3	Very high	41 Å²	41	30 Å²	30	22%	0.219	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-31.8	168.5	62.7	-47.6	0	0	0	112.4	F224 N227 F236 R259	F224-D229 HydrophobicContact CD1-CB 3.7Å; F224-D229 WeakPolarHBondContact CD1-OD2 3.46Å; F224-D229 HydrophobicContact CE1-CB 3.48Å; F224-D229 VanDerWaalsContact CE1-CB 3.48Å; F224-D229 HydrophobicContact CG-CB 4.44Å; F224-D229 HydrophobicContact CZ-CB 4.03Å; N227-D229 PolarHBondContact O-N 3.46Å; D229-F236 HydrophobicContact CB-CZ 4.41Å; D229-R259 IonicContact OD1-CZ 3.64Å; D229-R259 IonicContact OD1-NH1 3.37Å; D229-R259 PolarHBondContact OD1-NH1 2.88Å; D229-R259 IonicContact OD1-NH2 3.34Å; D229-R259 PolarHBondContact OD1-NH2 3.02Å; D229-R259 IonicContact OD2-CZ 3.33Å; D229-R259 IonicContact OD2-NH1 2.94Å; D229-R259 PolarHBondContact OD2-NH1 3.06Å; D229-R259 IonicContact OD2-NH2 2.95Å; D229-R259 PolarHBondContact OD2-NH2 3.45Å
230	L	96.5	Very high	96.1	Very high	30 Å²	30	32 Å²	32	16%	0.157	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-42.2	179.2	-50.7	-175.3	0	0	0	111.5	N227 G232 W381 W382 P383 I386	N227-L230 HydrophobicContact CB-CB 4.39Å; N227-L230 HydrophobicContact CB-CD1 4.27Å; N227-L230 HydrophobicContact CB-CG 4.42Å; N227-L230 PolarHBondContact O-N 2.76Å; L230-G232 PolarHBondContact O-N 3.18Å; L230-W381 HydrophobicContact CB-CH2 3.7Å; L230-W381 HydrophobicContact CB-CZ3 3.92Å; L230-W381 WeakPolarHBondContact O-CZ3 3.3Å; L230-W382 HydrophobicContact CD1-CD2 3.54Å; L230-W382 HydrophobicContact CD1-CE3 3.84Å; L230-W382 HydrophobicContact CD1-CG 3.88Å; L230-W382 HydrophobicContact CD1-CH2 4.43Å; L230-W382 HydrophobicContact CD1-CZ2 4.2Å; L230-W382 HydrophobicContact CD1-CZ3 4.27Å; L230-P383 HydrophobicContact CD2-CG 4.05Å; L230-I386 HydrophobicContact CD1-CD1 3.94Å; L230-I386 HydrophobicContact CD2-CD1 3.45Å; L230-I386 VanDerWaalsContact CD2-CD1 3.45Å; L230-I386 HydrophobicContact CG-CD1 4.28Å
231	S	96.5	Very high	96.4	Very high	5 Å²	5	28.9 Å²	28.9	4%	0.035	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	11.2	-175.6	63	0	0	0	0	114.1	Y61 N227 A228 G233	Y61-S231 WeakPolarHBondContact CD1-OG 3.37Å; Y61-S231 WeakPolarHBondContact CE1-OG 3.43Å; N227-S231 PolarHBondContact O-N 3.27Å; N227-S231 PolarHBondContact O-OG 3.4Å; A228-S231 WeakPolarHBondContact CA-OG 3.5Å; S231-G233 VanDerWaalsContact C-N 3.29Å; S231-G233 PolarHBondContact O-N 3.08Å
232	G	95.6	Very high	96.5	Very high	41 Å²	41	30.6 Å²	30.6	42%	0.423	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	27.1	179.3	0	0	0	0	0	113.7	N48 L230	N48-G232 PolarHBondContact ND2-O 3.3Å; L230-G232 PolarHBondContact O-N 3.18Å
233	G	97.6	Very high	96.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	19%	0.191	C	C	.	.			trans	-87.8	-7.3	179.7	0	0	0	0	0	115	T47 A228 S231	T47-G233 WeakPolarHBondContact CB-O 3.3Å; T47-G233 PolarHBondContact OG1-O 3.05Å; A228-G233 CarbonylContact O-C 3.51Å; A228-G233 WeakPolarHBondContact O-CA 3.49Å; A228-G233 PolarHBondContact O-N 3.39Å; S231-G233 VanDerWaalsContact C-N 3.29Å; S231-G233 PolarHBondContact O-N 3.08Å
234	V	97.9	Very high	96.5	Very high	12 Å²	12	32.5 Å²	32.5	7%	0.073	20%	0.203	C	C	.	.			trans	-128.7	130.2	177.9	-176.5	0	0	0	0	109.5	P223 A228 F236 T247	P223-V234 HydrophobicContact CB-CG2 4.11Å; A228-V234 HydrophobicContact CB-CG2 3.75Å; A228-V234 PolarHBondContact O-N 2.58Å; V234-F236 HydrophobicContact CB-CE1 4.46Å; V234-F236 HydrophobicContact CB-CE2 4.46Å; V234-F236 HydrophobicContact CB-CZ 4.08Å; V234-F236 HydrophobicContact CG1-CD1 4.13Å; V234-F236 HydrophobicContact CG1-CE1 3.62Å; V234-F236 HydrophobicContact CG1-CE2 4.32Å; V234-F236 HydrophobicContact CG1-CZ 3.73Å; V234-T247 HydrophobicContact CG1-CG2 3.95Å; V234-T247 HydrophobicContact CG2-CG2 4.47Å
235	S	97.6	Very high	96.5	Very high	15 Å²	15	39.1 Å²	39.1	11%	0.105	23%	0.234	C	C	.	.			trans	-100	126.8	168.2	175	0	0	0	0	109.6	T47 S237 K238	T47-S235 PolarHBondContact O-N 2.88Å; S235-S237 PolarHBondContact OG-N 2.86Å; S235-S237 PolarHBondContact OG-OG 3.17Å; S235-K238 WeakPolarHBondContact O-CG 3.31Å; S235-K238 PolarHBondContact OG-N 3.13Å
236	F	94.5	Very high	96.4	Very high	95 Å²	95	40 Å²	40	42%	0.417	24%	0.239	S	C	.	.	S	Bend	trans	-92.6	-7.2	176	-57.4	-72.9	0	0	0	112.8	F224 D229 V234 H251	F224-F236 HydrophobicContact CE1-CZ 4.39Å; F224-F236 HydrophobicContact CE2-CE1 4.09Å; F224-F236 HydrophobicContact CE2-CZ 4.06Å; F224-F236 AromaticContact CZ-CE1 3.81Å; F224-F236 HydrophobicContact CZ-CE1 3.81Å; F224-F236 AromaticContact CZ-CZ 3.51Å; F224-F236 HydrophobicContact CZ-CZ 3.51Å; D229-F236 HydrophobicContact CB-CZ 4.41Å; V234-F236 HydrophobicContact CB-CE1 4.46Å; V234-F236 HydrophobicContact CB-CE2 4.46Å; V234-F236 HydrophobicContact CB-CZ 4.08Å; V234-F236 HydrophobicContact CG1-CD1 4.13Å; V234-F236 HydrophobicContact CG1-CE1 3.62Å; V234-F236 HydrophobicContact CG1-CE2 4.32Å; V234-F236 HydrophobicContact CG1-CZ 3.73Å; F236-H251 HydrophobicContact CD1-CB 4Å; F236-H251 AromaticContact CD1-CD2 3.61Å; F236-H251 AromaticContact CD1-CG 3.59Å; F236-H251 AromaticContact CD1-ND1 3.97Å; F236-H251 AromaticContact CD2-CD2 3.92Å; F236-H251 AromaticContact CD2-NE2 3.85Å; F236-H251 HydrophobicContact CE1-CB 3.61Å; F236-H251 AromaticContact CE1-CD2 3.42Å; F236-H251 VanDerWaalsContact CE1-CD2 3.42Å; F236-H251 WeakPolarHBondContact CE1-CD2 3.34Å; F236-H251 AromaticContact CE1-CG 3.53Å; F236-H251 AromaticContact CE2-CD2 3.74Å; F236-H251 AromaticContact CG-CD2 3.87Å; F236-H251 AromaticContact CG-NE2 3.82Å; F236-H251 HydrophobicContact CZ-CB 4.34Å; F236-H251 AromaticContact CZ-CD2 3.49Å; F236-H251 VanDerWaalsContact CZ-CD2 3.49Å; F236-H251 WeakPolarHBondContact CZ-CD2 3.19Å
237	S	94.7	Very high	96.4	Very high	109 Å²	109	40 Å²	40	76%	0.762	24%	0.239	S	C	*	.	S	Bend	trans	-103.2	-1.7	179.1	60.5	0	0	0	0	113.5	S235	S235-S237 PolarHBondContact OG-N 2.86Å; S235-S237 PolarHBondContact OG-OG 3.17Å
238	K	96.2	Very high	96.3	Very high	28 Å²	28	41.4 Å²	41.4	12%	0.122	25%	0.251	C	S	.	.	S	Bend	trans	-81.9	169.4	179	71	170.7	-67.5	177.2	0	112.7	Q43 I46 T47 N48 D49 S235 Y241	Q43-K238 WeakPolarHBondContact O-CE 3.44Å; Q43-K238 PolarHBondContact O-NZ 2.85Å; I46-K238 PolarHBondContact O-NZ 3.42Å; T47-K238 WeakPolarHBondContact O-CD 3.16Å; N48-K238 WeakPolarHBondContact O-CD 3.4Å; N48-K238 WeakPolarHBondContact O-CE 3.47Å; N48-K238 PolarHBondContact O-NZ 3.45Å; D49-K238 HydrophobicContact CB-CB 3.94Å; S235-K238 WeakPolarHBondContact O-CG 3.31Å; S235-K238 PolarHBondContact OG-N 3.13Å; K238-Y241 HydrophobicContact CD-CD1 3.97Å; K238-Y241 HydrophobicContact CD-CE1 4.34Å; K238-Y241 HydrophobicContact CG-CD1 4.38Å
239	G	93	Very high	96.2	Very high	44 Å²	44	49.2 Å²	49.2	45%	0.454	28%	0.281	S	S	.	.			trans	-74.9	-179.2	172.9	0	0	0	0	0	113.6
240	C	96.4	Very high	96.2	Very high	100 Å²	100	48 Å²	48	68%	0.676	28%	0.275	S	S	*	.			trans	-58.9	138.4	-173.5	-61	0	0	0	0	113.8	Q244	C240-Q244 VanDerWaalsContact CA-OE1 3.25Å; C240-Q244 PolarHBondContact SG-NE2 3.46Å
241	Y	98	Very high	96	Very high	22 Å²	22	50.2 Å²	50.2	9%	0.086	28%	0.284	C	S	.	.			trans	-138.2	162.8	171.1	65.6	-88.2	0	0	0	112.5	G44 T47 L65 K238 G243 Q244 T247	G44-Y241 CarbonylContact O-C 3.45Å; G44-Y241 WeakPolarHBondContact O-CA 3.42Å; G44-Y241 WeakPolarHBondContact O-CB 3.48Å; T47-Y241 HydrophobicContact CG2-CD2 4.29Å; T47-Y241 HydrophobicContact CG2-CE2 3.68Å; L65-Y241 HydrophobicContact CD1-CE2 3.92Å; K238-Y241 HydrophobicContact CD-CD1 3.97Å; K238-Y241 HydrophobicContact CD-CE1 4.34Å; K238-Y241 HydrophobicContact CG-CD1 4.38Å; Y241-G243 PolarHBondContact O-N 2.75Å; Y241-Q244 HydrophobicContact CD1-CB 3.91Å; Y241-Q244 HydrophobicContact CD2-CB 3.95Å; Y241-Q244 HydrophobicContact CE1-CB 3.57Å; Y241-Q244 HydrophobicContact CE2-CB 3.58Å; Y241-Q244 HydrophobicContact CG-CB 4.09Å; Y241-Q244 VanDerWaalsContact N-OE1 3.14Å; Y241-Q244 WeakPolarHBondContact O-CB 3.14Å; Y241-Q244 WeakPolarHBondContact O-CG 3.2Å; Y241-Q244 PolarHBondContact O-N 3.32Å; Y241-T247 WeakPolarHBondContact OH-CB 3.13Å; Y241-T247 WeakPolarHBondContact OH-CG2 3.09Å
242	I	97.3	Very high	96	Very high	36 Å²	36	58 Å²	58	19%	0.185	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	129.9	-178.5	-170	62.5	0	0	0	112.1	G44 L45 Y109 Q244	G44-I242 PolarHBondContact O-N 2.84Å; L45-I242 HydrophobicContact CD2-CB 4.4Å; L45-I242 HydrophobicContact CD2-CG2 3.96Å; Y109-I242 HydrophobicContact CE1-CD1 4.11Å; Y109-I242 HydrophobicContact CE1-CG1 4.43Å; Y109-I242 HydrophobicContact CE2-CG1 4.49Å; Y109-I242 WeakPolarHBondContact OH-CD1 3.29Å; Y109-I242 WeakPolarHBondContact OH-CG1 3.43Å; I242-Q244 VanDerWaalsContact C-N 3.31Å; I242-Q244 PolarHBondContact O-N 3.03Å
243	G	96.5	Very high	95.9	Very high	11 Å²	11	60 Å²	60	11%	0.113	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	12.4	177.4	0	0	0	0	0	115.2	N66 G69 Y241 E245	N66-G243 WeakPolarHBondContact O-CA 3.28Å; G69-G243 WeakPolarHBondContact CA-O 3.48Å; Y241-G243 PolarHBondContact O-N 2.75Å; G243-E245 VanDerWaalsContact C-N 3.33Å; G243-E245 PolarHBondContact O-N 2.9Å
244	Q	97	Very high	95.5	Very high	58 Å²	58	62.5 Å²	62.5	27%	0.271	35%	0.347	S	S	.	.	H	α-helix	trans	-63.9	-30.7	-176.5	68.9	-178.5	-3.6	0	0	115.2	C240 Y241 I242 L246 T247 A248	C240-Q244 VanDerWaalsContact CA-OE1 3.25Å; C240-Q244 PolarHBondContact SG-NE2 3.46Å; Y241-Q244 HydrophobicContact CD1-CB 3.91Å; Y241-Q244 HydrophobicContact CD2-CB 3.95Å; Y241-Q244 HydrophobicContact CE1-CB 3.57Å; Y241-Q244 HydrophobicContact CE2-CB 3.58Å; Y241-Q244 HydrophobicContact CG-CB 4.09Å; Y241-Q244 VanDerWaalsContact N-OE1 3.14Å; Y241-Q244 WeakPolarHBondContact O-CB 3.14Å; Y241-Q244 WeakPolarHBondContact O-CG 3.2Å; Y241-Q244 PolarHBondContact O-N 3.32Å; I242-Q244 VanDerWaalsContact C-N 3.31Å; I242-Q244 PolarHBondContact O-N 3.03Å; Q244-L246 VanDerWaalsContact C-N 3.3Å; Q244-L246 PolarHBondContact O-N 3.49Å; Q244-T247 CarbonylContact O-C 3.6Å; Q244-T247 WeakPolarHBondContact O-CA 3.3Å; Q244-T247 WeakPolarHBondContact O-CB 3.15Å; Q244-T247 PolarHBondContact O-N 2.76Å; Q244-A248 PolarHBondContact O-N 3.05Å
245	E	96.6	Very high	95.1	Very high	147 Å²	147	65.8 Å²	65.8	69%	0.687	37%	0.367	S	S	*	.	H	α-helix	trans	-52.6	-46.8	-168.6	-179.1	58.7	-153.5	0	0	112.7	G243 T247 R249	G243-E245 VanDerWaalsContact C-N 3.33Å; G243-E245 PolarHBondContact O-N 2.9Å; E245-T247 PolarHBondContact O-N 2.86Å; E245-R249 WeakPolarHBondContact O-CB 3.31Å; E245-R249 PolarHBondContact O-N 2.98Å
246	L	95	Very high	94.9	Very high	44 Å²	44	67 Å²	67	23%	0.23	37%	0.372	C	S	.	.	H	α-helix	trans	-70	-34.5	-179.6	-173.1	55.3	0	0	0	112.5	L222 Q244 T250	L222-L246 HydrophobicContact CD2-CD2 3.48Å; L222-L246 VanDerWaalsContact CD2-CD2 3.48Å; L222-L246 HydrophobicContact CD2-CG 3.73Å; Q244-L246 VanDerWaalsContact C-N 3.3Å; Q244-L246 PolarHBondContact O-N 3.49Å; L246-T250 WeakPolarHBondContact O-CB 3.39Å; L246-T250 PolarHBondContact O-N 2.9Å; L246-T250 PolarHBondContact O-OG1 3.39Å
247	T	96.2	Very high	94.8	Very high	1 Å²	1	71 Å²	71	1%	0.006	39%	0.385	C	S	.	.	H	α-helix	trans	-68.6	-47.6	177.3	-54.4	0	0	0	0	110.2	P223 F224 V234 Y241 Q244 E245 T250 H251	P223-T247 HydrophobicContact CB-CG2 4.27Å; P223-T247 HydrophobicContact CG-CG2 4.38Å; F224-T247 HydrophobicContact CD2-CG2 4.28Å; F224-T247 HydrophobicContact CE2-CG2 3.84Å; V234-T247 HydrophobicContact CG1-CG2 3.95Å; V234-T247 HydrophobicContact CG2-CG2 4.47Å; Y241-T247 WeakPolarHBondContact OH-CB 3.13Å; Y241-T247 WeakPolarHBondContact OH-CG2 3.09Å; Q244-T247 CarbonylContact O-C 3.6Å; Q244-T247 WeakPolarHBondContact O-CA 3.3Å; Q244-T247 WeakPolarHBondContact O-CB 3.15Å; Q244-T247 PolarHBondContact O-N 2.76Å; E245-T247 PolarHBondContact O-N 2.86Å; T247-T250 PolarHBondContact O-N 3.29Å; T247-H251 PolarHBondContact O-N 2.88Å
248	A	95.9	Very high	94.9	Very high	31 Å²	31	67.8 Å²	67.8	26%	0.256	36%	0.356	S	S	.	.	H	α-helix	trans	-59.8	-47.6	176.6	0	0	0	0	0	111.1	Q244 T250 H251 F252	Q244-A248 PolarHBondContact O-N 3.05Å; A248-T250 VanDerWaalsContact C-N 3.32Å; A248-T250 PolarHBondContact O-N 2.9Å; A248-H251 WeakPolarHBondContact O-CB 3.23Å; A248-H251 PolarHBondContact O-N 3.17Å; A248-F252 HydrophobicContact CB-CD2 4.4Å; A248-F252 HydrophobicContact CB-CE2 4.17Å; A248-F252 WeakPolarHBondContact O-CD2 3.18Å; A248-F252 PolarHBondContact O-N 2.81Å
249	R	95.4	Very high	95	Very high	163 Å²	163	66.8 Å²	66.8	62%	0.615	35%	0.351	S	S	*	.	H	α-helix	trans	-57.1	-44	175.1	-179.9	179.9	168.3	-171.7	-1.5	112.3	E245 H251 F252 T253	E245-R249 WeakPolarHBondContact O-CB 3.31Å; E245-R249 PolarHBondContact O-N 2.98Å; R249-H251 VanDerWaalsContact C-N 3.34Å; R249-F252 PolarHBondContact O-N 2.99Å; R249-T253 HydrophobicContact CG-CG2 4.26Å; R249-T253 VanDerWaalsContact O-CG2 3.29Å; R249-T253 WeakPolarHBondContact O-CG2 3.44Å; R249-T253 PolarHBondContact O-N 3.15Å; R249-T253 PolarHBondContact O-OG1 3.23Å; R249-T253 VanDerWaalsContact O-OG1 3.07Å
250	T	94.9	Very high	95.2	Very high	16 Å²	16	64.7 Å²	64.7	10%	0.098	33%	0.33	C	S	.	.	H	α-helix	trans	-64.7	-40.5	179.5	-55.6	0	0	0	0	111.5	F224 L246 T247 A248 T253 G254 I256	F224-T250 HydrophobicContact CB-CG2 4.07Å; F224-T250 HydrophobicContact CD1-CG2 4.33Å; F224-T250 HydrophobicContact CD2-CG2 3.76Å; F224-T250 HydrophobicContact CE2-CG2 4.26Å; F224-T250 HydrophobicContact CG-CG2 3.79Å; L246-T250 WeakPolarHBondContact O-CB 3.39Å; L246-T250 PolarHBondContact O-N 2.9Å; L246-T250 PolarHBondContact O-OG1 3.39Å; T247-T250 PolarHBondContact O-N 3.29Å; A248-T250 VanDerWaalsContact C-N 3.32Å; A248-T250 PolarHBondContact O-N 2.9Å; T250-T253 PolarHBondContact O-OG1 2.88Å; T250-G254 PolarHBondContact O-N 3.46Å; T250-I256 HydrophobicContact CG2-CD1 4.43Å; T250-I256 HydrophobicContact CG2-CG1 4.05Å
251	H	94.1	Very high	95.2	Very high	77 Å²	77	59.9 Å²	59.9	36%	0.356	30%	0.297	S	S	.	.	H	α-helix	trans	-61	-49.5	174.1	179.9	-101.4	0	0	0	112	F224 F236 T247 A248 R249 G254	F224-H251 HydrophobicContact CE2-CB 4.18Å; F224-H251 HydrophobicContact CZ-CB 3.71Å; F236-H251 HydrophobicContact CD1-CB 4Å; F236-H251 AromaticContact CD1-CD2 3.61Å; F236-H251 AromaticContact CD1-CG 3.59Å; F236-H251 AromaticContact CD1-ND1 3.97Å; F236-H251 AromaticContact CD2-CD2 3.92Å; F236-H251 AromaticContact CD2-NE2 3.85Å; F236-H251 HydrophobicContact CE1-CB 3.61Å; F236-H251 AromaticContact CE1-CD2 3.42Å; F236-H251 VanDerWaalsContact CE1-CD2 3.42Å; F236-H251 WeakPolarHBondContact CE1-CD2 3.34Å; F236-H251 AromaticContact CE1-CG 3.53Å; F236-H251 AromaticContact CE2-CD2 3.74Å; F236-H251 AromaticContact CG-CD2 3.87Å; F236-H251 AromaticContact CG-NE2 3.82Å; F236-H251 HydrophobicContact CZ-CB 4.34Å; F236-H251 AromaticContact CZ-CD2 3.49Å; F236-H251 VanDerWaalsContact CZ-CD2 3.49Å; F236-H251 WeakPolarHBondContact CZ-CD2 3.19Å; T247-H251 PolarHBondContact O-N 2.88Å; A248-H251 WeakPolarHBondContact O-CB 3.23Å; A248-H251 PolarHBondContact O-N 3.17Å; R249-H251 VanDerWaalsContact C-N 3.34Å; H251-G254 PolarHBondContact O-N 2.84Å
252	F	94.5	Very high	95.2	Very high	169 Å²	169	58.9 Å²	58.9	74%	0.741	29%	0.293	S	S	*	.	H	α-helix	trans	-71.1	-33.3	-176.9	-69.6	-57.1	0	0	0	113.9	A248 R249 G254	A248-F252 HydrophobicContact CB-CD2 4.4Å; A248-F252 HydrophobicContact CB-CE2 4.17Å; A248-F252 WeakPolarHBondContact O-CD2 3.18Å; A248-F252 PolarHBondContact O-N 2.81Å; R249-F252 PolarHBondContact O-N 2.99Å; F252-G254 VanDerWaalsContact C-N 3.35Å
253	T	93.7	Very high	95.1	Very high	82 Å²	82	57.1 Å²	57.1	50%	0.503	28%	0.284	S	S	.	.	H	α-helix	trans	-78	-24	175	62.4	0	0	0	0	112.3	R249 T250 V255	R249-T253 HydrophobicContact CG-CG2 4.26Å; R249-T253 VanDerWaalsContact O-CG2 3.29Å; R249-T253 WeakPolarHBondContact O-CG2 3.44Å; R249-T253 PolarHBondContact O-N 3.15Å; R249-T253 PolarHBondContact O-OG1 3.23Å; R249-T253 VanDerWaalsContact O-OG1 3.07Å; T250-T253 PolarHBondContact O-OG1 2.88Å; T253-V255 PolarHBondContact O-N 3.11Å
254	G	89.1	Confident	94.9	Very high	52 Å²	52	60.1 Å²	60.1	54%	0.536	29%	0.294	S	S	.	.			trans	68.5	7.3	-178.4	0	0	0	0	0	114.5	T250 H251 F252 I256	T250-G254 PolarHBondContact O-N 3.46Å; H251-G254 PolarHBondContact O-N 2.84Å; F252-G254 VanDerWaalsContact C-N 3.35Å; G254-I256 PolarHBondContact O-N 3.16Å
255	V	89.7	Confident	94.5	Very high	81 Å²	81	57.5 Å²	57.5	49%	0.491	28%	0.282	S	S	.	.			trans	-97.1	97.6	-176.2	-177.4	0	0	0	0	110.8	T253 R257	T253-V255 PolarHBondContact O-N 3.11Å; V255-R257 HydrophobicContact CG1-CG 4.14Å
256	I	93.4	Very high	93.9	Very high	42 Å²	42	53.1 Å²	53.1	22%	0.215	27%	0.265	C	S	.	.			trans	-106.2	107.4	172.2	-58.4	79	0	0	0	108.8	F224 T250 G254 R258 R259	F224-I256 HydrophobicContact CB-CG1 3.86Å; F224-I256 HydrophobicContact CB-CG2 4.25Å; F224-I256 HydrophobicContact CD1-CD1 3.86Å; F224-I256 HydrophobicContact CD1-CG1 3.57Å; F224-I256 HydrophobicContact CE1-CD1 4.24Å; F224-I256 HydrophobicContact CE1-CG1 4.42Å; F224-I256 HydrophobicContact CG-CG1 4.01Å; T250-I256 HydrophobicContact CG2-CD1 4.43Å; T250-I256 HydrophobicContact CG2-CG1 4.05Å; G254-I256 PolarHBondContact O-N 3.16Å; I256-R258 VanDerWaalsContact CG2-O 3.26Å; I256-R258 WeakPolarHBondContact CG2-O 3.32Å; I256-R259 HydrophobicContact CG2-CG 3.86Å
257	R	93.5	Very high	93	Very high	179 Å²	179	52.3 Å²	52.3	68%	0.675	26%	0.263	S	S	*	.			trans	-82.1	-33.5	-176.8	-64.9	-172.7	178.1	95.8	-0.6	113.5	V255 R343 L344	V255-R257 HydrophobicContact CG1-CG 4.14Å; R257-R343 VanDerWaalsContact O-CA 3.28Å; R257-R343 WeakPolarHBondContact O-CA 3.3Å; R257-L344 PolarHBondContact O-N 2.88Å
258	R	96.4	Very high	91.6	Very high	41 Å²	41	56 Å²	56	16%	0.155	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	146.3	-173.9	-69	175.5	170.9	169.2	-5.3	110.6	E225 I256 L341 I342 R343	E225-R258 HydrophobicContact CG-CB 4.03Å; E225-R258 WeakPolarHBondContact CG-O 3.26Å; I256-R258 VanDerWaalsContact CG2-O 3.26Å; I256-R258 WeakPolarHBondContact CG2-O 3.32Å; R258-L341 HydrophobicContact CB-CD1 3.88Å; R258-L341 HydrophobicContact CB-CG 4.44Å; R258-I342 WeakPolarHBondContact CA-O 3.45Å; R258-I342 WeakPolarHBondContact CB-O 3.12Å; R258-R343 HydrophobicContact CG-CB 4.23Å; R258-R343 HydrophobicContact CG-CG 3.45Å; R258-R343 VanDerWaalsContact CG-CG 3.45Å; R258-R343 VanDerWaalsContact NE-CG 3.33Å
259	R	97.6	Very high	90.2	Very high	6 Å²	6	57 Å²	57	2%	0.023	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	153.4	170	-71.6	-174.8	177.2	-89.6	1.3	110.3	F224 E225 N227 D229 I256 V261 I342 L344 W382	F224-R259 PolarHBondContact O-NH1 3.31Å; E225-R259 WeakPolarHBondContact O-CA 3.34Å; N227-R259 WeakPolarHBondContact OD1-CD 3.27Å; N227-R259 WeakPolarHBondContact OD1-CG 3.35Å; N227-R259 PolarHBondContact OD1-NH1 2.98Å; D229-R259 IonicContact OD1-CZ 3.64Å; D229-R259 IonicContact OD1-NH1 3.37Å; D229-R259 PolarHBondContact OD1-NH1 2.88Å; D229-R259 IonicContact OD1-NH2 3.34Å; D229-R259 PolarHBondContact OD1-NH2 3.02Å; D229-R259 IonicContact OD2-CZ 3.33Å; D229-R259 IonicContact OD2-NH1 2.94Å; D229-R259 PolarHBondContact OD2-NH1 3.06Å; D229-R259 IonicContact OD2-NH2 2.95Å; D229-R259 PolarHBondContact OD2-NH2 3.45Å; I256-R259 HydrophobicContact CG2-CG 3.86Å; R259-V261 HydrophobicContact CB-CG1 4.32Å; R259-V261 PolarHBondContact O-N 3Å; R259-I342 PolarHBondContact N-O 3.4Å; R259-I342 VanDerWaalsContact N-O 3.11Å; R259-I342 PolarHBondContact O-N 3.28Å; R259-L344 HydrophobicContact CB-CD1 4.39Å; R259-L344 HydrophobicContact CB-CD2 4.31Å; R259-L344 HydrophobicContact CG-CD1 4.01Å; R259-W382 HydrophobicContact CB-CH2 4.18Å; R259-W382 HydrophobicContact CB-CZ3 4.4Å
260	Y	97.8	Very high	88.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	118.9	162.5	-77.4	-95.9	0	0	0	108.3	P210 E215 F216 I217 T221 E225 N227 R309 I339 A340 L341 W382	P210-Y260 HydrophobicContact CB-CD1 3.79Å; P210-Y260 HydrophobicContact CB-CD2 4.45Å; P210-Y260 HydrophobicContact CB-CE1 4.19Å; P210-Y260 HydrophobicContact CB-CG 3.93Å; P210-Y260 HydrophobicContact CG-CD1 4.18Å; P210-Y260 HydrophobicContact CG-CD2 4.06Å; P210-Y260 HydrophobicContact CG-CG 3.78Å; E215-Y260 WeakPolarHBondContact O-CE1 3.27Å; E215-Y260 PolarHBondContact O-OH 3.47Å; E215-Y260 VanDerWaalsContact O-OH 3.06Å; F216-Y260 VanDerWaalsContact CA-OH 3.3Å; F216-Y260 WeakPolarHBondContact CA-OH 3.17Å; F216-Y260 HydrophobicContact CD1-CE2 4.15Å; F216-Y260 HydrophobicContact CE1-CE2 4.46Å; I217-Y260 PolarHBondContact N-OH 3.36Å; T221-Y260 HydrophobicContact CG2-CE2 3.75Å; T221-Y260 PolarHBondContact OG1-OH 2.89Å; E225-Y260 VanDerWaalsContact O-CD2 3.28Å; E225-Y260 WeakPolarHBondContact O-CD2 3.01Å; E225-Y260 PolarHBondContact O-N 2.93Å; N227-Y260 PolarHBondContact ND2-O 2.8Å; Y260-R309 HydrophobicContact CD1-CG 4.02Å; Y260-R309 HydrophobicContact CE1-CB 4.09Å; Y260-R309 HydrophobicContact CE1-CG 3.5Å; Y260-R309 VanDerWaalsContact CE1-CG 3.5Å; Y260-I339 HydrophobicContact CD1-CD1 4.34Å; Y260-I339 HydrophobicContact CD1-CG1 4.32Å; Y260-A340 CarbonylContact C-O 3.37Å; Y260-A340 VanDerWaalsContact CA-O 3.31Å; Y260-A340 WeakPolarHBondContact CA-O 3.29Å; Y260-L341 HydrophobicContact CD1-CB 4.41Å; Y260-L341 HydrophobicContact CD2-CD1 3.91Å; Y260-L341 HydrophobicContact CE1-CB 4.24Å; Y260-L341 HydrophobicContact CE2-CB 4.37Å; Y260-L341 HydrophobicContact CE2-CD1 3.89Å; Y260-L341 HydrophobicContact CE2-CG 4.49Å; Y260-L341 HydrophobicContact CG-CD1 4.47Å; Y260-W382 WeakPolarHBondContact O-CH2 3.3Å
261	V	97.6	Very high	87.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	150.1	179.4	-53.5	0	0	0	0	110.6	R259 I263 I339 A340 I342 L344 P376 I378 W382	R259-V261 HydrophobicContact CB-CG1 4.32Å; R259-V261 PolarHBondContact O-N 3Å; V261-I263 HydrophobicContact CG2-CG2 4.05Å; V261-I339 WeakPolarHBondContact O-CA 3.36Å; V261-I339 WeakPolarHBondContact O-CG1 3.17Å; V261-A340 PolarHBondContact N-O 3.04Å; V261-A340 PolarHBondContact O-N 3.44Å; V261-I342 HydrophobicContact CB-CD1 4.31Å; V261-I342 HydrophobicContact CB-CG1 4.43Å; V261-I342 HydrophobicContact CG1-CD1 4.11Å; V261-I342 HydrophobicContact CG1-CG1 3.97Å; V261-I342 HydrophobicContact CG2-CD1 3.29Å; V261-I342 HydrophobicContact CG2-CG1 3.58Å; V261-I342 HydrophobicContact CG2-CG2 4.38Å; V261-L344 HydrophobicContact CG1-CD2 4.02Å; V261-P376 HydrophobicContact CG2-CB 3.89Å; V261-I378 HydrophobicContact CG1-CD1 4.14Å; V261-W382 HydrophobicContact CG1-CH2 4.22Å; V261-W382 HydrophobicContact CG1-CZ3 4.49Å
262	P	96.8	Very high	85.9	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	140.2	163.2	-8.7	15.9	0	0	0	111.3	W205 P376 Y377 P379	W205-P262 WeakPolarHBondContact O-CB 3.31Å; W205-P262 WeakPolarHBondContact O-CG 3.43Å; P262-P376 WeakPolarHBondContact O-CA 3.2Å; P262-Y377 HydrophobicContact CB-CD1 3.96Å; P262-Y377 HydrophobicContact CB-CD2 3.71Å; P262-Y377 HydrophobicContact CB-CE1 3.48Å; P262-Y377 VanDerWaalsContact CB-CE1 3.48Å; P262-Y377 HydrophobicContact CB-CE2 3.23Å; P262-Y377 HydrophobicContact CB-CG 4.07Å; P262-Y377 WeakPolarHBondContact CB-OH 3.34Å; P262-Y377 VanDerWaalsContact CD-O 3.25Å; P262-Y377 WeakPolarHBondContact CD-O 3.42Å; P262-Y377 HydrophobicContact CG-CD2 3.91Å; P262-Y377 HydrophobicContact CG-CE2 3.65Å; P262-Y377 WeakPolarHBondContact CG-O 3.25Å; P262-Y377 PolarHBondContact O-N 3.43Å; P262-Y377 VanDerWaalsContact O-N 3.11Å; P262-P379 HydrophobicContact CG-CG 3.68Å
263	I	95.4	Very high	84.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	148.6	172.5	57	161.6	0	0	0	111.2	V261 I265 I308 S337 G338 A340 I374 P376	V261-I263 HydrophobicContact CG2-CG2 4.05Å; I263-I265 HydrophobicContact CD1-CD1 4.03Å; I263-I265 HydrophobicContact CD1-CG1 3.99Å; I263-I308 HydrophobicContact CD1-CG1 4.13Å; I263-S337 WeakPolarHBondContact O-CA 3.28Å; I263-G338 VanDerWaalsContact CG1-C 3.44Å; I263-G338 WeakPolarHBondContact CG1-O 3.49Å; I263-G338 PolarHBondContact N-O 2.9Å; I263-G338 PolarHBondContact O-N 3.47Å; I263-A340 HydrophobicContact CD1-CB 3.91Å; I263-A340 HydrophobicContact CG1-CB 4.26Å; I263-A340 HydrophobicContact CG2-CB 3.72Å; I263-I374 HydrophobicContact CB-CG2 3.84Å; I263-I374 HydrophobicContact CD1-CG2 3.98Å; I263-I374 HydrophobicContact CG2-CG2 3.66Å; I263-P376 HydrophobicContact CG2-CB 4.3Å
264	K	92.3	Very high	83.1	Confident	74 Å²	74	46.5 Å²	46.5	32%	0.322	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	139.7	160.3	-73.8	178.9	179.5	-173	0	108.6	P335 I336 I375 Y377	K264-P335 HydrophobicContact CB-CB 4.18Å; K264-P335 HydrophobicContact CD-CB 4.26Å; K264-P335 HydrophobicContact CD-CG 3.85Å; K264-P335 HydrophobicContact CG-CB 4.31Å; K264-P335 HydrophobicContact CG-CG 4.31Å; K264-I336 CarbonylContact C-O 3.57Å; K264-I336 VanDerWaalsContact CA-O 3.31Å; K264-I336 WeakPolarHBondContact CA-O 3.4Å; K264-I375 HydrophobicContact CB-CB 4.26Å; K264-I375 PolarHBondContact N-O 2.86Å; K264-I375 PolarHBondContact O-N 3.11Å; K264-Y377 HydrophobicContact CD-CE1 4.5Å; K264-Y377 HydrophobicContact CG-CD1 4.24Å; K264-Y377 HydrophobicContact CG-CE1 3.86Å
265	I	88.9	Confident	81.9	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.3	176.4	-51.7	-175.2	0	0	0	107.9	I263 I283 I308 V311 I336 L372 E373 I374	I263-I265 HydrophobicContact CD1-CD1 4.03Å; I263-I265 HydrophobicContact CD1-CG1 3.99Å; I265-I283 HydrophobicContact CD1-CD1 4.24Å; I265-I308 HydrophobicContact CD1-CD1 4.01Å; I265-V311 HydrophobicContact CD1-CG1 3.39Å; I265-I336 HydrophobicContact CB-CB 4.09Å; I265-I336 HydrophobicContact CB-CG2 4.36Å; I265-I336 HydrophobicContact CD1-CG2 4.35Å; I265-I336 PolarHBondContact N-O 2.89Å; I265-I336 PolarHBondContact O-N 3.32Å; I265-L372 HydrophobicContact CG2-CB 3.82Å; I265-L372 HydrophobicContact CG2-CD1 3.99Å; I265-L372 HydrophobicContact CG2-CD2 4.19Å; I265-L372 HydrophobicContact CG2-CG 4.23Å; I265-E373 WeakPolarHBondContact CA-O 3.44Å; I265-I374 HydrophobicContact CB-CD1 4.32Å; I265-I374 HydrophobicContact CD1-CD1 4.06Å; I265-I374 HydrophobicContact CG1-CD1 3.74Å; I265-I374 HydrophobicContact CG2-CD1 4.03Å
266	V	84.1	Confident	80.8	Confident	56 Å²	56	47.8 Å²	47.8	34%	0.339	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	123.5	175.6	-177.4	0	0	0	0	107.3	E373 I375	V266-E373 HydrophobicContact CB-CB 4.4Å; V266-E373 PolarHBondContact N-O 3.22Å; V266-E373 PolarHBondContact O-N 2.94Å; V266-I375 HydrophobicContact CG2-CD1 3.71Å
267	S	75.1	Confident	79.2	Confident	26 Å²	26	50.1 Å²	50.1	18%	0.182	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	138.7	174	-176.6	0	0	0	0	110.6	G269 I271	S267-G269 VanDerWaalsContact C-N 3.34Å; S267-G269 PolarHBondContact OG-N 3.46Å; S267-G269 PolarHBondContact OG-O 3.11Å; S267-I271 VanDerWaalsContact CB-CD1 3.43Å; S267-I271 VanDerWaalsContact OG-CG1 3.3Å; S267-I271 WeakPolarHBondContact OG-CG1 3.38Å
268	M	68.2	Low	77.8	Confident	80 Å²	80	46.2 Å²	46.2	39%	0.394	26%	0.263	S	S	.	.	S	Bend	trans	-94.1	11.1	173.6	-69.1	179	156.5	0	0	112.9	H295 E373	M268-H295 WeakPolarHBondContact CE-CE1 3.49Å; M268-H295 PolarHBondContact SD-CE1 3.12Å; M268-E373 HydrophobicContact CE-CB 3.73Å; M268-E373 HydrophobicContact CE-CG 4.19Å; M268-E373 WeakPolarHBondContact CE-OE2 2.99Å; M268-E373 HydrophobicContact SD-CB 4.33Å
269	G	66.2	Low	76.4	Confident	50 Å²	50	44.3 Å²	44.3	52%	0.515	26%	0.256	S	S	.	.	S	Bend	trans	-166	-165	-179	0	0	0	0	0	113.3	S267 I271	S267-G269 VanDerWaalsContact C-N 3.34Å; S267-G269 PolarHBondContact OG-N 3.46Å; S267-G269 PolarHBondContact OG-O 3.11Å; G269-I271 PolarHBondContact O-N 3.49Å; G269-I271 VanDerWaalsContact O-N 3.07Å
270	N	63.7	Low	75	Confident	111 Å²	111	46.4 Å²	46.4	59%	0.594	27%	0.267	S	S	*	.			trans	-66.4	110.8	-179.6	-168.6	-8.2	0	0	0	111.1	D272	N270-D272 PolarHBondContact ND2-OD2 3.22Å; N270-D272 PolarHBondContact O-N 2.91Å; N270-D272 WeakPolarHBondContact OD1-CB 3.41Å; N270-D272 PolarHBondContact OD1-N 3.06Å; N270-D272 PolarHBondContact OD1-OD2 3Å
271	I	64.7	Low	73.9	Confident	53 Å²	53	51.6 Å²	51.6	27%	0.272	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-64.7	-21.7	177.8	-74	177.7	0	0	0	112.3	S267 G269 A273 L274 F316 I336	S267-I271 VanDerWaalsContact CB-CD1 3.43Å; S267-I271 VanDerWaalsContact OG-CG1 3.3Å; S267-I271 WeakPolarHBondContact OG-CG1 3.38Å; G269-I271 PolarHBondContact O-N 3.49Å; G269-I271 VanDerWaalsContact O-N 3.07Å; I271-A273 PolarHBondContact O-N 3.04Å; I271-L274 WeakPolarHBondContact O-CB 3.24Å; I271-L274 PolarHBondContact O-N 3.32Å; I271-F316 HydrophobicContact CG2-CD1 3.12Å; I271-F316 HydrophobicContact CG2-CE1 3.25Å; I271-F316 HydrophobicContact CG2-CG 4.26Å; I271-F316 HydrophobicContact CG2-CZ 4.45Å; I271-I336 HydrophobicContact CD1-CD1 4.47Å
272	D	65.2	Low	73.1	Confident	84 Å²	84	53.4 Å²	53.4	45%	0.449	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-54.2	-33.2	-174	-67.2	-31	0	0	0	113.3	N270 L274 K275	N270-D272 PolarHBondContact ND2-OD2 3.22Å; N270-D272 PolarHBondContact O-N 2.91Å; N270-D272 WeakPolarHBondContact OD1-CB 3.41Å; N270-D272 PolarHBondContact OD1-N 3.06Å; N270-D272 PolarHBondContact OD1-OD2 3Å; D272-L274 VanDerWaalsContact C-N 3.33Å; D272-L274 PolarHBondContact O-N 3.11Å; D272-K275 HydrophobicContact CB-CD 4.49Å; D272-K275 VanDerWaalsContact O-CB 3.23Å; D272-K275 WeakPolarHBondContact O-CB 3.35Å; D272-K275 VanDerWaalsContact O-CG 3.3Å; D272-K275 WeakPolarHBondContact O-CG 3.46Å; D272-K275 PolarHBondContact O-N 2.88Å; D272-K275 VanDerWaalsContact OD1-CE 3.26Å; D272-K275 WeakPolarHBondContact OD1-CE 3.47Å; D272-K275 IonicContact OD1-NZ 2.65Å; D272-K275 PolarHBondContact OD1-NZ 3.05Å
273	A	64.6	Low	72.6	Confident	38 Å²	38	53.5 Å²	53.5	31%	0.314	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-73.4	-20.2	179.6	0	0	0	0	0	113.9	I271 K275 L360 I370	I271-A273 PolarHBondContact O-N 3.04Å; A273-K275 PolarHBondContact O-N 3.21Å; A273-L360 HydrophobicContact CB-CD1 4.09Å; A273-L360 HydrophobicContact CB-CD2 3.73Å; A273-L360 WeakPolarHBondContact O-CD2 3.35Å; A273-I370 HydrophobicContact CB-CD1 3.89Å
274	L	65.7	Low	72.2	Confident	1 Å²	1	57 Å²	57	1%	0.005	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-73.2	-12.5	171.1	-72.7	174.2	0	0	0	113.2	I271 D272 T276 F316 I358 I370 L372	I271-L274 WeakPolarHBondContact O-CB 3.24Å; I271-L274 PolarHBondContact O-N 3.32Å; D272-L274 VanDerWaalsContact C-N 3.33Å; D272-L274 PolarHBondContact O-N 3.11Å; L274-T276 PolarHBondContact O-N 3.13Å; L274-T276 VanDerWaalsContact O-N 3.14Å; L274-F316 HydrophobicContact CB-CE1 4.1Å; L274-F316 HydrophobicContact CD1-CE1 3.93Å; L274-F316 HydrophobicContact CD1-CZ 4.43Å; L274-I358 HydrophobicContact CD2-CB 4Å; L274-I358 HydrophobicContact CD2-CG1 4.36Å; L274-I358 HydrophobicContact CD2-CG2 3.69Å; L274-I370 HydrophobicContact CD1-CD1 4.46Å; L274-I370 HydrophobicContact CD1-CG2 4.24Å; L274-I370 HydrophobicContact CD2-CB 4.38Å; L274-I370 HydrophobicContact CD2-CD1 3.9Å; L274-I370 HydrophobicContact CG-CD1 3.63Å; L274-I370 HydrophobicContact CG-CG2 4.42Å; L274-L372 HydrophobicContact CD1-CD1 3.89Å; L274-L372 HydrophobicContact CD1-CD2 3.87Å; L274-L372 HydrophobicContact CD1-CG 4.32Å
275	K	63.4	Low	72.1	Confident	98 Å²	98	57.7 Å²	57.7	43%	0.426	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-70.8	-5.8	-175.1	-61.6	176.5	177.2	174.7	0	113.5	D272 A273 F316	D272-K275 HydrophobicContact CB-CD 4.49Å; D272-K275 VanDerWaalsContact O-CB 3.23Å; D272-K275 WeakPolarHBondContact O-CB 3.35Å; D272-K275 VanDerWaalsContact O-CG 3.3Å; D272-K275 WeakPolarHBondContact O-CG 3.46Å; D272-K275 PolarHBondContact O-N 2.88Å; D272-K275 VanDerWaalsContact OD1-CE 3.26Å; D272-K275 WeakPolarHBondContact OD1-CE 3.47Å; D272-K275 IonicContact OD1-NZ 2.65Å; D272-K275 PolarHBondContact OD1-NZ 3.05Å; A273-K275 PolarHBondContact O-N 3.21Å; K275-F316 WeakPolarHBondContact CE-O 3.41Å
276	T	65.6	Low	72.3	Confident	62 Å²	62	57.8 Å²	57.8	38%	0.38	33%	0.33	S	S	.	.	S	Bend	trans	-73.4	140.7	173.6	73.5	0	0	0	0	111	L274 I278 S279 L280	L274-T276 PolarHBondContact O-N 3.13Å; L274-T276 VanDerWaalsContact O-N 3.14Å; T276-I278 PolarHBondContact O-N 3.44Å; T276-I278 VanDerWaalsContact O-N 3.11Å; T276-S279 PolarHBondContact O-N 3.14Å; T276-S279 WeakPolarHBondContact OG1-CB 3.25Å; T276-S279 PolarHBondContact OG1-N 2.97Å; T276-S279 PolarHBondContact OG1-OG 3.21Å; T276-L280 WeakPolarHBondContact O-CB 3.36Å; T276-L280 PolarHBondContact O-N 2.91Å
277	S	60.2	Low	72.7	Confident	91 Å²	91	57 Å²	57	64%	0.636	33%	0.326	S	S	*	.	H	α-helix	trans	-57.4	-28.5	178.4	-53.7	0	0	0	0	113.4	N281	S277-N281 PolarHBondContact O-N 2.88Å; S277-N281 VanDerWaalsContact O-N 3.16Å; S277-N281 PolarHBondContact O-ND2 2.86Å
278	I	63.6	Low	73.7	Confident	98 Å²	98	55.8 Å²	55.8	50%	0.503	32%	0.317	S	S	.	.	H	α-helix	trans	-70.3	-53.4	178.5	-64.2	166.6	0	0	0	109.8	T276 L280 N281 S282 H361	T276-I278 PolarHBondContact O-N 3.44Å; T276-I278 VanDerWaalsContact O-N 3.11Å; I278-L280 PolarHBondContact O-N 2.72Å; I278-N281 PolarHBondContact O-N 3.06Å; I278-N281 VanDerWaalsContact O-N 3.16Å; I278-S282 PolarHBondContact O-N 2.97Å; I278-S282 VanDerWaalsContact O-N 3.12Å; I278-S282 PolarHBondContact O-OG 3.34Å; I278-S282 VanDerWaalsContact O-OG 3.12Å; I278-H361 HydrophobicContact CG2-CB 4.14Å
279	S	68	Low	74.9	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.007	31%	0.308	C	S	.	.	H	α-helix	trans	-62.7	-32.2	176.8	-63.4	0	0	0	0	112.4	T276 S282 I283	T276-S279 PolarHBondContact O-N 3.14Å; T276-S279 WeakPolarHBondContact OG1-CB 3.25Å; T276-S279 PolarHBondContact OG1-N 2.97Å; T276-S279 PolarHBondContact OG1-OG 3.21Å; S279-S282 WeakPolarHBondContact O-CB 3.45Å; S279-S282 PolarHBondContact O-N 2.99Å; S279-I283 PolarHBondContact O-N 3.31Å
280	L	69	Low	76.1	Confident	49 Å²	49	52 Å²	52	26%	0.257	28%	0.284	S	S	.	.	H	α-helix	trans	-61.3	-45.2	173.9	-169.3	62.5	0	0	0	112.1	T276 I278 S282 I283 M313	T276-L280 WeakPolarHBondContact O-CB 3.36Å; T276-L280 PolarHBondContact O-N 2.91Å; I278-L280 PolarHBondContact O-N 2.72Å; L280-S282 VanDerWaalsContact C-N 3.28Å; L280-S282 PolarHBondContact O-N 3.49Å; L280-I283 WeakPolarHBondContact O-CG2 3.18Å; L280-I283 PolarHBondContact O-N 2.76Å; L280-M313 HydrophobicContact CD1-CB 3.75Å; L280-M313 HydrophobicContact CD1-CE 3.04Å; L280-M313 HydrophobicContact CD1-CG 3.35Å; L280-M313 HydrophobicContact CD1-SD 3.85Å
281	N	73.1	Confident	77.3	Confident	110 Å²	110	46.8 Å²	46.8	59%	0.588	26%	0.256	S	S	*	.	H	α-helix	trans	-68.3	-31.5	176.4	-74.6	-30.5	0	0	0	112.1	S277 I278 I283 Y284	S277-N281 PolarHBondContact O-N 2.88Å; S277-N281 VanDerWaalsContact O-N 3.16Å; S277-N281 PolarHBondContact O-ND2 2.86Å; I278-N281 PolarHBondContact O-N 3.06Å; I278-N281 VanDerWaalsContact O-N 3.16Å; N281-I283 PolarHBondContact O-N 2.86Å; N281-Y284 PolarHBondContact O-N 2.62Å
282	S	81.2	Confident	78.4	Confident	37 Å²	37	46.1 Å²	46.1	26%	0.259	25%	0.253	S	S	.	.	H	α-helix	trans	-67.1	-20.9	177.9	-57.8	0	0	0	0	113.9	I278 S279 L280	I278-S282 PolarHBondContact O-N 2.97Å; I278-S282 VanDerWaalsContact O-N 3.12Å; I278-S282 PolarHBondContact O-OG 3.34Å; I278-S282 VanDerWaalsContact O-OG 3.12Å; S279-S282 WeakPolarHBondContact O-CB 3.45Å; S279-S282 PolarHBondContact O-N 2.99Å; L280-S282 VanDerWaalsContact C-N 3.28Å; L280-S282 PolarHBondContact O-N 3.49Å
283	I	85.6	Confident	79.2	Confident	2 Å²	2	47 Å²	47	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-72.3	-31.4	176.1	-151.9	170	0	0	0	112.1	I265 S279 L280 N281 A286 I308 V311 M313 I358 L372	I265-I283 HydrophobicContact CD1-CD1 4.24Å; S279-I283 PolarHBondContact O-N 3.31Å; L280-I283 WeakPolarHBondContact O-CG2 3.18Å; L280-I283 PolarHBondContact O-N 2.76Å; N281-I283 PolarHBondContact O-N 2.86Å; I283-A286 WeakPolarHBondContact O-CB 3.21Å; I283-A286 PolarHBondContact O-N 2.83Å; I283-A286 VanDerWaalsContact O-N 3.16Å; I283-I308 HydrophobicContact CG1-CD1 3.94Å; I283-I308 WeakPolarHBondContact O-CB 3.08Å; I283-I308 WeakPolarHBondContact O-CG2 3.45Å; I283-V311 HydrophobicContact CD1-CG1 4.44Å; I283-V311 HydrophobicContact CD1-CG2 4.26Å; I283-V311 HydrophobicContact CG2-CG2 3.57Å; I283-M313 HydrophobicContact CD1-CE 4.47Å; I283-M313 HydrophobicContact CD1-SD 4.33Å; I283-I358 HydrophobicContact CB-CD1 4.23Å; I283-I358 HydrophobicContact CG1-CD1 4.04Å; I283-I358 HydrophobicContact CG1-CG1 4.47Å; I283-L372 HydrophobicContact CD1-CD1 3.92Å
284	Y	87.7	Confident	79.9	Confident	74 Å²	74	51.2 Å²	51.2	29%	0.29	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	132.4	178	-56.7	-56.6	0	0	0	109.8	N281 A286 N310 V311	N281-Y284 PolarHBondContact O-N 2.62Å; Y284-A286 PolarHBondContact O-N 2.96Å; Y284-N310 VanDerWaalsContact CE1-OD1 3.3Å; Y284-N310 WeakPolarHBondContact CE1-OD1 2.91Å; Y284-V311 HydrophobicContact CD1-CG2 4.41Å; Y284-V311 HydrophobicContact CE1-CG2 3.8Å
285	N	90.6	Very high	80.2	Confident	88 Å²	88	53.4 Å²	53.4	47%	0.471	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	12.4	-171	-46.8	-71.1	0	0	0	114.5	I308 R309	N285-I308 WeakPolarHBondContact CA-O 3.02Å; N285-I308 PolarHBondContact N-O 2.83Å; N285-R309 PolarHBondContact OD1-NH1 2.8Å; N285-R309 PolarHBondContact OD1-NH2 3.44Å
286	A	91.9	Very high	80.7	Confident	5 Å²	5	54.9 Å²	54.9	4%	0.041	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-64.4	132.3	-179.7	0	0	0	0	0	111.2	I283 Y284 W307 I308 V356 I358	I283-A286 WeakPolarHBondContact O-CB 3.21Å; I283-A286 PolarHBondContact O-N 2.83Å; I283-A286 VanDerWaalsContact O-N 3.16Å; Y284-A286 PolarHBondContact O-N 2.96Å; A286-W307 CarbonylContact O-C 3.59Å; A286-W307 VanDerWaalsContact O-CA 3.28Å; A286-W307 WeakPolarHBondContact O-CA 3.41Å; A286-I308 HydrophobicContact CB-CD1 4.49Å; A286-I308 PolarHBondContact O-N 2.96Å; A286-V356 HydrophobicContact CB-CG1 3.46Å; A286-V356 VanDerWaalsContact CB-CG1 3.46Å; A286-I358 HydrophobicContact CB-CD1 3.69Å
287	P	94.2	Very high	81	Confident	39 Å²	39	55.4 Å²	55.4	25%	0.253	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	133.5	-178.6	27.5	-32.9	0	0	0	111.7	Y289 P304	P287-Y289 HydrophobicContact CB-CE2 3.87Å; P287-Y289 HydrophobicContact CG-CE2 3.74Å; P287-P304 HydrophobicContact CB-CB 3.77Å; P287-P304 HydrophobicContact CB-CG 3.64Å
288	I	94.7	Very high	81.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	126.8	176.1	-59	165.9	0	0	0	108.9	P304 I305 G306 I308 A340 I342 L354 I355 V356 I374	I288-P304 CarbonylContact O-C 3.53Å; I288-P304 VanDerWaalsContact O-CA 3.32Å; I288-P304 WeakPolarHBondContact O-CA 3.32Å; I288-I305 HydrophobicContact CB-CG1 4.4Å; I288-I305 HydrophobicContact CG2-CD1 4.3Å; I288-I305 HydrophobicContact CG2-CG1 4.02Å; I288-I305 WeakPolarHBondContact O-CG1 3.39Å; I288-I305 PolarHBondContact O-N 3.43Å; I288-G306 PolarHBondContact N-O 2.88Å; I288-I308 HydrophobicContact CD1-CG1 4.16Å; I288-I308 HydrophobicContact CG1-CG1 4.18Å; I288-A340 HydrophobicContact CD1-CB 3.7Å; I288-I342 HydrophobicContact CD1-CG2 3.79Å; I288-L354 HydrophobicContact CG2-CB 3.96Å; I288-I355 WeakPolarHBondContact CA-O 3.49Å; I288-V356 HydrophobicContact CB-CG2 4.17Å; I288-V356 HydrophobicContact CG1-CG2 3.51Å; I288-I374 HydrophobicContact CD1-CG2 4.37Å; I288-I374 HydrophobicContact CG1-CG1 4.49Å
289	Y	93.3	Very high	80.9	Confident	50 Å²	50	57 Å²	57	20%	0.196	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	154.8	176.9	-60.6	-83.2	0	0	0	111.1	P287 L297 P304 L354 I355	P287-Y289 HydrophobicContact CB-CE2 3.87Å; P287-Y289 HydrophobicContact CG-CE2 3.74Å; Y289-L297 HydrophobicContact CD1-CD2 4.11Å; Y289-L297 HydrophobicContact CG-CD2 4.27Å; Y289-P304 HydrophobicContact CE1-CB 4.39Å; Y289-P304 HydrophobicContact CE1-CG 3.74Å; Y289-L354 CarbonylContact O-C 3.48Å; Y289-L354 WeakPolarHBondContact O-CA 3.44Å; Y289-I355 PolarHBondContact N-O 3.04Å; Y289-I355 PolarHBondContact O-N 3.22Å
290	Q	91.9	Very high	80.1	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.009	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.7	171.7	-171.9	179.8	33.5	0	0	108.8	K301 I305 E346 E349 Y352 K353 L354	Q290-K301 VanDerWaalsContact OE1-CD 3.24Å; Q290-I305 HydrophobicContact CB-CG2 4.28Å; Q290-E346 PolarHBondContact NE2-O 3.34Å; Q290-E349 PolarHBondContact NE2-OE2 3.16Å; Q290-E349 PolarHBondContact OE1-OE2 3.34Å; Q290-Y352 VanDerWaalsContact CG-CB 3.44Å; Q290-Y352 HydrophobicContact CG-CD1 4.44Å; Q290-Y352 HydrophobicContact CG-CD2 4.26Å; Q290-Y352 HydrophobicContact CG-CG 3.81Å; Q290-K353 WeakPolarHBondContact CA-O 3.46Å; Q290-L354 HydrophobicContact CB-CD2 4.18Å; Q290-L354 HydrophobicContact CG-CD2 4.14Å
291	V	90.1	Very high	79.7	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	159.2	179.8	-66.4	0	0	0	0	111	E296 L297 Y352 K353 I355	V291-E296 WeakPolarHBondContact CB-O 3.18Å; V291-E296 WeakPolarHBondContact CG1-O 3.39Å; V291-L297 HydrophobicContact CG1-CG 4.23Å; V291-Y352 CarbonylContact O-C 3.49Å; V291-Y352 VanDerWaalsContact O-CA 3.29Å; V291-Y352 WeakPolarHBondContact O-CA 3.36Å; V291-Y352 VanDerWaalsContact O-CB 3.3Å; V291-Y352 WeakPolarHBondContact O-CB 3.43Å; V291-K353 HydrophobicContact CG2-CB 4.1Å; V291-K353 PolarHBondContact N-O 3.04Å; V291-K353 PolarHBondContact O-N 3.21Å; V291-I355 HydrophobicContact CB-CD1 4.28Å; V291-I355 HydrophobicContact CB-CG1 4.48Å; V291-I355 HydrophobicContact CG1-CD1 3.33Å; V291-I355 HydrophobicContact CG1-CG1 3.73Å; V291-I355 HydrophobicContact CG2-CB 4.36Å; V291-I355 HydrophobicContact CG2-CD1 3.99Å; V291-I355 HydrophobicContact CG2-CG1 3.93Å; V291-I355 HydrophobicContact CG2-CG2 3.6Å
292	D	87.2	Confident	79.7	Confident	39 Å²	39	63.2 Å²	63.2	21%	0.209	33%	0.329	C	S	.	.			trans	-72.3	-179	171.9	69.3	12.3	0	0	0	112.3	N294 H295 E296	D292-N294 PolarHBondContact O-N 3Å; D292-N294 WeakPolarHBondContact OD1-CA 3.45Å; D292-N294 WeakPolarHBondContact OD1-CB 3.33Å; D292-N294 PolarHBondContact OD1-N 2.9Å; D292-H295 PolarHBondContact O-N 3.03Å; D292-H295 PolarHBondContact OD1-N 3.49Å; D292-H295 VanDerWaalsContact OD1-N 3.08Å; D292-E296 PolarHBondContact N-O 3.48Å; D292-E296 PolarHBondContact OD1-N 2.88Å
293	N	82	Confident	80	Confident	104 Å²	104	67.7 Å²	67.7	56%	0.556	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.2	178.6	-72.2	-31.3	0	0	0	113.7	H295	N293-H295 VanDerWaalsContact C-N 3.29Å
294	N	78.9	Confident	80.4	Confident	126 Å²	126	68.8 Å²	68.8	67%	0.674	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	4.9	176.3	-63.6	-21.7	0	0	0	112.3	D292 E296	D292-N294 PolarHBondContact O-N 3Å; D292-N294 WeakPolarHBondContact OD1-CA 3.45Å; D292-N294 WeakPolarHBondContact OD1-CB 3.33Å; D292-N294 PolarHBondContact OD1-N 2.9Å; N294-E296 PolarHBondContact O-N 3.37Å
295	H	72.2	Confident	80.7	Confident	46 Å²	46	65.5 Å²	65.5	21%	0.213	34%	0.338	C	S	.	.			trans	66.2	16.4	-178.9	-66.7	-82.9	0	0	0	114.7	M268 D292 N293 K353 Q371	M268-H295 WeakPolarHBondContact CE-CE1 3.49Å; M268-H295 PolarHBondContact SD-CE1 3.12Å; D292-H295 PolarHBondContact O-N 3.03Å; D292-H295 PolarHBondContact OD1-N 3.49Å; D292-H295 VanDerWaalsContact OD1-N 3.08Å; N293-H295 VanDerWaalsContact C-N 3.29Å; H295-K353 VanDerWaalsContact CE1-CD 3.43Å; H295-K353 WeakPolarHBondContact CE1-CD 3.39Å; H295-K353 PolarHBondContact NE2-NZ 3.2Å; H295-Q371 PolarHBondContact ND1-NE2 3.15Å
296	E	74.1	Confident	80.9	Confident	130 Å²	130	61.3 Å²	61.3	61%	0.607	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-84.6	140	176.7	-67.5	-170.2	175.6	0	0	111.4	V291 D292 N294 L298	V291-E296 WeakPolarHBondContact CB-O 3.18Å; V291-E296 WeakPolarHBondContact CG1-O 3.39Å; D292-E296 PolarHBondContact N-O 3.48Å; D292-E296 PolarHBondContact OD1-N 2.88Å; N294-E296 PolarHBondContact O-N 3.37Å; E296-L298 PolarHBondContact O-N 3.04Å
297	L	71.6	Confident	81.1	Confident	72 Å²	72	64.2 Å²	64.2	38%	0.377	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-69.5	123.2	172.6	-80.9	106.5	0	0	0	109.9	Y289 V291 Q299 L302	Y289-L297 HydrophobicContact CD1-CD2 4.11Å; Y289-L297 HydrophobicContact CG-CD2 4.27Å; V291-L297 HydrophobicContact CG1-CG 4.23Å; L297-Q299 PolarHBondContact O-N 3.16Å; L297-L302 HydrophobicContact CD2-CD2 4.06Å
298	L	63.9	Low	81.1	Confident	39 Å²	39	62.3 Å²	62.3	20%	0.204	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-63.6	118.4	171.5	-63.2	160.2	0	0	0	108.8	E296 S300 K301 Y352	E296-L298 PolarHBondContact O-N 3.04Å; L298-S300 PolarHBondContact O-N 3Å; L298-K301 HydrophobicContact CB-CB 4.08Å; L298-K301 HydrophobicContact CB-CG 4.3Å; L298-K301 HydrophobicContact CD1-CD 3.78Å; L298-K301 HydrophobicContact CD1-CG 4.37Å; L298-K301 CarbonylContact O-C 3.52Å; L298-K301 PolarHBondContact O-N 3.21Å; L298-Y352 HydrophobicContact CD1-CD1 3.83Å; L298-Y352 HydrophobicContact CD1-CE1 3.49Å; L298-Y352 VanDerWaalsContact CD1-CE1 3.49Å; L298-Y352 HydrophobicContact CD2-CE1 4.26Å; L298-Y352 HydrophobicContact CG-CE1 4.44Å
299	Q	57.6	Low	81.1	Confident	185 Å²	185	63 Å²	63	86%	0.864	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-53.3	-30.7	-178.1	-68.8	179.9	2.9	0	0	113.2	L297	L297-Q299 PolarHBondContact O-N 3.16Å
300	S	51.5	Low	81.1	Confident	113 Å²	113	61.8 Å²	61.8	79%	0.79	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-81.4	-10.6	176.9	59.6	0	0	0	0	114.7	L298	L298-S300 PolarHBondContact O-N 3Å
301	K	60.7	Low	81	Confident	56 Å²	56	61.9 Å²	61.9	24%	0.243	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-124.6	39.1	-175.5	-57.9	-170.6	179.6	176.1	0	113.3	Q290 L298 K303 E349	Q290-K301 VanDerWaalsContact OE1-CD 3.24Å; L298-K301 HydrophobicContact CB-CB 4.08Å; L298-K301 HydrophobicContact CB-CG 4.3Å; L298-K301 HydrophobicContact CD1-CD 3.78Å; L298-K301 HydrophobicContact CD1-CG 4.37Å; L298-K301 CarbonylContact O-C 3.52Å; L298-K301 PolarHBondContact O-N 3.21Å; K301-K303 PolarHBondContact O-N 3.28Å; K301-E349 IonicContact NZ-OE1 3.48Å; K301-E349 IonicContact NZ-OE2 3.94Å; K301-E349 PolarHBondContact NZ-OE2 2.73Å
302	L	72.6	Confident	80.8	Confident	121 Å²	121	62.3 Å²	62.3	63%	0.634	32%	0.316	S	S	*	.			trans	-63.3	-0.3	172.2	-73.7	168.7	0	0	0	114.8	L297	L297-L302 HydrophobicContact CD2-CD2 4.06Å
303	K	88.3	Confident	80.1	Confident	131 Å²	131	61.2 Å²	61.2	57%	0.57	31%	0.309	S	S	*	.	S	Bend	trans	-91.1	130.9	180	-173.7	171.1	-177.5	162.3	0	110.4	K301 I305	K301-K303 PolarHBondContact O-N 3.28Å; K303-I305 PolarHBondContact O-N 2.85Å
304	P	93.2	Very high	79.4	Confident	24 Å²	24	59.6 Å²	59.6	16%	0.156	30%	0.301	C	S	.	.			trans	-54.8	131	171.5	-24.2	32.5	0	0	0	111.5	P287 I288 Y289 G306 W307	P287-P304 HydrophobicContact CB-CB 3.77Å; P287-P304 HydrophobicContact CB-CG 3.64Å; I288-P304 CarbonylContact O-C 3.53Å; I288-P304 VanDerWaalsContact O-CA 3.32Å; I288-P304 WeakPolarHBondContact O-CA 3.32Å; Y289-P304 HydrophobicContact CE1-CB 4.39Å; Y289-P304 HydrophobicContact CE1-CG 3.74Å; P304-G306 VanDerWaalsContact C-N 3.29Å; P304-W307 HydrophobicContact CB-CZ2 4.11Å
305	I	93.6	Very high	78.3	Confident	5 Å²	5	56.5 Å²	56.5	3%	0.026	28%	0.284	C	S	.	.	S	Bend	trans	-82.2	-16	173.5	66.2	153.8	0	0	0	111.3	I288 Q290 K303 R343 E346 L354	I288-I305 HydrophobicContact CB-CG1 4.4Å; I288-I305 HydrophobicContact CG2-CD1 4.3Å; I288-I305 HydrophobicContact CG2-CG1 4.02Å; I288-I305 WeakPolarHBondContact O-CG1 3.39Å; I288-I305 PolarHBondContact O-N 3.43Å; Q290-I305 HydrophobicContact CB-CG2 4.28Å; K303-I305 PolarHBondContact O-N 2.85Å; I305-R343 VanDerWaalsContact O-CG 3.29Å; I305-R343 WeakPolarHBondContact O-CG 3.3Å; I305-R343 PolarHBondContact O-N 2.86Å; I305-E346 HydrophobicContact CB-CB 4.28Å; I305-E346 HydrophobicContact CD1-CB 4.32Å; I305-E346 HydrophobicContact CG2-CB 3.84Å; I305-E346 HydrophobicContact CG2-CG 4.07Å; I305-L354 HydrophobicContact CD1-CD1 3.98Å; I305-L354 HydrophobicContact CD1-CD2 3.4Å; I305-L354 HydrophobicContact CD1-CG 4.27Å
306	G	95	Very high	77.2	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.5	-173.9	-176.9	0	0	0	0	0	112.9	I288 P304 L341	I288-G306 PolarHBondContact N-O 2.88Å; P304-G306 VanDerWaalsContact C-N 3.29Å; G306-L341 CarbonylContact C-O 3.56Å; G306-L341 WeakPolarHBondContact CA-O 3.34Å
307	W	96	Very high	75.5	Confident	66 Å²	66	53.7 Å²	53.7	25%	0.25	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	137.6	177.7	-61.9	-93.7	0	0	0	110.7	A286 P304 R309 A340 L341	A286-W307 CarbonylContact O-C 3.59Å; A286-W307 VanDerWaalsContact O-CA 3.28Å; A286-W307 WeakPolarHBondContact O-CA 3.41Å; P304-W307 HydrophobicContact CB-CZ2 4.11Å; W307-R309 WeakPolarHBondContact O-CG 3.38Å; W307-A340 WeakPolarHBondContact O-CA 3.06Å; W307-A340 WeakPolarHBondContact O-CB 3.49Å; W307-L341 PolarHBondContact N-O 2.87Å; W307-L341 PolarHBondContact O-N 2.89Å
308	I	95.2	Very high	73.7	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	137	165.6	-64.3	-178.7	0	0	0	108.1	I263 I265 I283 N285 A286 I288 V311 V356 I374	I263-I308 HydrophobicContact CD1-CG1 4.13Å; I265-I308 HydrophobicContact CD1-CD1 4.01Å; I283-I308 HydrophobicContact CG1-CD1 3.94Å; I283-I308 WeakPolarHBondContact O-CB 3.08Å; I283-I308 WeakPolarHBondContact O-CG2 3.45Å; N285-I308 WeakPolarHBondContact CA-O 3.02Å; N285-I308 PolarHBondContact N-O 2.83Å; A286-I308 HydrophobicContact CB-CD1 4.49Å; A286-I308 PolarHBondContact O-N 2.96Å; I288-I308 HydrophobicContact CD1-CG1 4.16Å; I288-I308 HydrophobicContact CG1-CG1 4.18Å; I308-V311 HydrophobicContact CG2-CG1 3.76Å; I308-V356 HydrophobicContact CD1-CB 4.27Å; I308-V356 HydrophobicContact CD1-CG1 4.22Å; I308-V356 HydrophobicContact CD1-CG2 3.79Å; I308-V356 HydrophobicContact CG1-CG2 4.1Å; I308-I374 HydrophobicContact CD1-CD1 3.9Å
309	R	94.8	Very high	71.9	Confident	14 Å²	14	59.8 Å²	59.8	5%	0.053	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-46.3	-177.1	-55.8	-61.1	-42.9	154.7	13.1	110.6	K214 E215 F216 Y260 N285 W307 I339 L341	K214-R309 PolarHBondContact O-NH2 3.03Å; E215-R309 PolarHBondContact O-NE 3.49Å; E215-R309 PolarHBondContact O-NH2 2.86Å; F216-R309 PolarHBondContact O-NH2 2.81Å; Y260-R309 HydrophobicContact CD1-CG 4.02Å; Y260-R309 HydrophobicContact CE1-CB 4.09Å; Y260-R309 HydrophobicContact CE1-CG 3.5Å; Y260-R309 VanDerWaalsContact CE1-CG 3.5Å; N285-R309 PolarHBondContact OD1-NH1 2.8Å; N285-R309 PolarHBondContact OD1-NH2 3.44Å; W307-R309 WeakPolarHBondContact O-CG 3.38Å; R309-I339 HydrophobicContact CB-CG2 4.13Å; R309-I339 WeakPolarHBondContact CB-O 3.45Å; R309-I339 PolarHBondContact N-O 3.04Å; R309-L341 HydrophobicContact CG-CB 4.28Å
310	N	93.1	Very high	70.6	Confident	24 Å²	24	57 Å²	57	13%	0.128	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	158.6	174.4	-150.8	-14.5	0	0	0	111	W205 E215 Y284 G338 I339	W205-N310 HydrophobicContact CH2-CB 4.28Å; W205-N310 HydrophobicContact CZ2-CB 3.66Å; W205-N310 VanDerWaalsContact CZ2-CG 3.44Å; E215-N310 HydrophobicContact CG-CB 4.02Å; Y284-N310 VanDerWaalsContact CE1-OD1 3.3Å; Y284-N310 WeakPolarHBondContact CE1-OD1 2.91Å; N310-G338 CarbonylContact O-C 3.49Å; N310-G338 WeakPolarHBondContact O-CA 3.47Å; N310-I339 HydrophobicContact CB-CG2 4.1Å; N310-I339 PolarHBondContact N-O 3.21Å; N310-I339 PolarHBondContact O-N 2.87Å
311	V	90.1	Very high	69.6	Low	4 Å²	4	58.4 Å²	58.4	2%	0.024	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	145.9	-173.4	-73.2	0	0	0	0	110.1	W205 I265 I283 Y284 I308 M313 I336 S337	W205-V311 VanDerWaalsContact CZ3-C 3.47Å; I265-V311 HydrophobicContact CD1-CG1 3.39Å; I283-V311 HydrophobicContact CD1-CG1 4.44Å; I283-V311 HydrophobicContact CD1-CG2 4.26Å; I283-V311 HydrophobicContact CG2-CG2 3.57Å; Y284-V311 HydrophobicContact CD1-CG2 4.41Å; Y284-V311 HydrophobicContact CE1-CG2 3.8Å; I308-V311 HydrophobicContact CG2-CG1 3.76Å; V311-M313 HydrophobicContact CB-CG 4.4Å; V311-M313 HydrophobicContact CB-SD 4.09Å; V311-M313 HydrophobicContact CG2-CG 3.63Å; V311-M313 HydrophobicContact CG2-SD 3.49Å; V311-M313 WeakPolarHBondContact CG2-SD 3.47Å; V311-M313 PolarHBondContact O-N 3.06Å; V311-I336 HydrophobicContact CB-CG2 4.33Å; V311-S337 CarbonylContact C-O 3.54Å; V311-S337 WeakPolarHBondContact CA-O 3.37Å
312	N	85.4	Confident	68.3	Low	9 Å²	9	62.2 Å²	62.2	5%	0.048	32%	0.315	C	S	.	.			trans	-86.8	99.6	174.4	171	25.7	0	0	0	108.9	N202 W205 N314 N315 S337	N202-N312 PolarHBondContact ND2-ND2 3.25Å; N202-N312 WeakPolarHBondContact OD1-CB 3.47Å; W205-N312 HydrophobicContact CH2-CB 4.45Å; W205-N312 HydrophobicContact CZ3-CB 3.7Å; N312-N314 VanDerWaalsContact C-N 3.35Å; N312-N314 WeakPolarHBondContact OD1-CB 3.32Å; N312-N314 PolarHBondContact OD1-N 2.79Å; N312-N315 PolarHBondContact ND2-OD1 2.91Å; N312-S337 PolarHBondContact N-O 2.83Å
313	M	72.8	Confident	66.3	Low	16 Å²	16	63.5 Å²	63.5	8%	0.079	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-86.3	-6.4	-178.1	-59	-66.8	-71.1	0	0	112.7	L280 I283 V311 N315 F316	L280-M313 HydrophobicContact CD1-CB 3.75Å; L280-M313 HydrophobicContact CD1-CE 3.04Å; L280-M313 HydrophobicContact CD1-CG 3.35Å; L280-M313 HydrophobicContact CD1-SD 3.85Å; I283-M313 HydrophobicContact CD1-CE 4.47Å; I283-M313 HydrophobicContact CD1-SD 4.33Å; V311-M313 HydrophobicContact CB-CG 4.4Å; V311-M313 HydrophobicContact CB-SD 4.09Å; V311-M313 HydrophobicContact CG2-CG 3.63Å; V311-M313 HydrophobicContact CG2-SD 3.49Å; V311-M313 WeakPolarHBondContact CG2-SD 3.47Å; V311-M313 PolarHBondContact O-N 3.06Å; M313-N315 PolarHBondContact O-N 2.89Å; M313-F316 HydrophobicContact CB-CD2 4.19Å; M313-F316 HydrophobicContact CE-CD1 4.05Å; M313-F316 HydrophobicContact CE-CD2 3.67Å; M313-F316 HydrophobicContact CE-CE1 3.77Å; M313-F316 HydrophobicContact CE-CE2 3.32Å; M313-F316 HydrophobicContact CE-CG 4.01Å; M313-F316 HydrophobicContact CE-CZ 3.38Å; M313-F316 HydrophobicContact CG-CE2 4.47Å; M313-F316 VanDerWaalsContact O-CB 3.25Å; M313-F316 WeakPolarHBondContact O-CB 3.03Å; M313-F316 WeakPolarHBondContact O-CD2 3.43Å; M313-F316 PolarHBondContact O-N 2.89Å; M313-F316 HydrophobicContact SD-CD2 3.67Å; M313-F316 HydrophobicContact SD-CE2 3.13Å; M313-F316 WeakPolarHBondContact SD-CE2 3.28Å; M313-F316 HydrophobicContact SD-CZ 3.7Å
314	N	66	Low	64	Low	71 Å²	71	65.5 Å²	65.5	38%	0.38	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-63.4	-26.8	177.1	-68.3	-3.7	0	0	0	112.3	N198 N312 F316 I317	N198-N314 PolarHBondContact ND2-ND2 3.28Å; N312-N314 VanDerWaalsContact C-N 3.35Å; N312-N314 WeakPolarHBondContact OD1-CB 3.32Å; N312-N314 PolarHBondContact OD1-N 2.79Å; N314-F316 PolarHBondContact O-N 3.31Å; N314-F316 VanDerWaalsContact O-N 3.13Å; N314-I317 PolarHBondContact O-N 2.84Å
315	N	55.7	Low	61.1	Low	61 Å²	61	71.3 Å²	71.3	33%	0.326	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-64.9	-10.9	172	-70.9	15.4	0	0	0	112.9	N312 M313	N312-N315 PolarHBondContact ND2-OD1 2.91Å; M313-N315 PolarHBondContact O-N 2.89Å
316	F	50.9	Low	58.2	Low	15 Å²	15	78.4 Å²	78.4	7%	0.066	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-87.1	-16.9	175.6	-71.3	-111	0	0	0	113.6	I271 L274 K275 M313 N314 I336	I271-F316 HydrophobicContact CG2-CD1 3.12Å; I271-F316 HydrophobicContact CG2-CE1 3.25Å; I271-F316 HydrophobicContact CG2-CG 4.26Å; I271-F316 HydrophobicContact CG2-CZ 4.45Å; L274-F316 HydrophobicContact CB-CE1 4.1Å; L274-F316 HydrophobicContact CD1-CE1 3.93Å; L274-F316 HydrophobicContact CD1-CZ 4.43Å; K275-F316 WeakPolarHBondContact CE-O 3.41Å; M313-F316 HydrophobicContact CB-CD2 4.19Å; M313-F316 HydrophobicContact CE-CD1 4.05Å; M313-F316 HydrophobicContact CE-CD2 3.67Å; M313-F316 HydrophobicContact CE-CE1 3.77Å; M313-F316 HydrophobicContact CE-CE2 3.32Å; M313-F316 HydrophobicContact CE-CG 4.01Å; M313-F316 HydrophobicContact CE-CZ 3.38Å; M313-F316 HydrophobicContact CG-CE2 4.47Å; M313-F316 VanDerWaalsContact O-CB 3.25Å; M313-F316 WeakPolarHBondContact O-CB 3.03Å; M313-F316 WeakPolarHBondContact O-CD2 3.43Å; M313-F316 PolarHBondContact O-N 2.89Å; M313-F316 HydrophobicContact SD-CD2 3.67Å; M313-F316 HydrophobicContact SD-CE2 3.13Å; M313-F316 WeakPolarHBondContact SD-CE2 3.28Å; M313-F316 HydrophobicContact SD-CZ 3.7Å; N314-F316 PolarHBondContact O-N 3.31Å; N314-F316 VanDerWaalsContact O-N 3.13Å; F316-I336 HydrophobicContact CD2-CD1 4.05Å; F316-I336 HydrophobicContact CD2-CG1 3.94Å; F316-I336 HydrophobicContact CE1-CD1 3.88Å; F316-I336 HydrophobicContact CE2-CB 4.11Å; F316-I336 HydrophobicContact CE2-CD1 3.15Å; F316-I336 HydrophobicContact CE2-CG1 3.27Å; F316-I336 HydrophobicContact CE2-CG2 3.8Å; F316-I336 HydrophobicContact CZ-CD1 3.05Å; F316-I336 HydrophobicContact CZ-CG1 3.78Å; F316-I336 HydrophobicContact CZ-CG2 4.49Å
317	I	37.6	Very low	55	Low	102 Å²	102	87 Å²	87	52%	0.523	45%	0.447	S	S	.	.			trans	-106.5	102.1	-164.2	-51.6	178.1	0	0	0	111.2	N314 I331	N314-I317 PolarHBondContact O-N 2.84Å; I317-I331 WeakPolarHBondContact O-CD1 3.4Å
318	M	33	Very low	51.7	Low	112 Å²	112	88.5 Å²	88.5	55%	0.552	47%	0.468	S	S	*	.				162.9	108.1	125.1	-82	-56.1	-90.4	0	0	111.1	N320 I331	M318-N320 HydrophobicContact CE-CB 4.35Å; M318-I331 HydrophobicContact CB-CD1 3.95Å
319	I	27.8	Very low	48.6	Very low	127 Å²	127	97.1 Å²	97.1	65%	0.651	51%	0.506	S	S	*	.			trans	-135.8	95.7	135.6	-56.7	179	0	0	0	104.5	N321	I319-N321 VanDerWaalsContact C-N 3.33Å; I319-N321 HydrophobicContact CG2-CB 4.38Å; I319-N321 WeakPolarHBondContact CG2-OD1 3.31Å; I319-N321 PolarHBondContact O-N 3.16Å
320	N	29.1	Very low	45.3	Very low	125 Å²	125	104.3 Å²	104.3	67%	0.668	54%	0.544	S	S	*	.			trans	-77.5	97.7	156.3	-82.1	-12	0	0	0	104.9	M318 N322	M318-N320 HydrophobicContact CE-CB 4.35Å; N320-N322 PolarHBondContact O-N 3.28Å
321	N	31.5	Very low	42.6	Very low	144 Å²	144	106.4 Å²	106.4	77%	0.77	55%	0.554	S	S	*	*			trans	-71.8	69.3	164.3	-83.3	-21.2	0	0	0	107.7	I319	I319-N321 VanDerWaalsContact C-N 3.33Å; I319-N321 HydrophobicContact CG2-CB 4.38Å; I319-N321 WeakPolarHBondContact CG2-OD1 3.31Å; I319-N321 PolarHBondContact O-N 3.16Å
322	N	33	Very low	40.1	Very low	135 Å²	135	112.9 Å²	112.9	72%	0.722	59%	0.589	S	S	*	*			trans	-136.6	123.4	157.2	-84.3	-22.2	0	0	0	106	N320	N320-N322 PolarHBondContact O-N 3.28Å
323	D	31.2	Very low	38.2	Very low	148 Å²	148	120.1 Å²	120.1	79%	0.791	63%	0.627	S	S	*	*			trans	91.1	111.5	171.2	-51.1	-31.9	0	0	0	116.5	D325	D323-D325 PolarHBondContact O-N 2.82Å
324	N	38.4	Very low	37.4	Very low	173 Å²	173	120.9 Å²	120.9	93%	0.925	64%	0.639	S	S	*	*			trans	-67.6	46.7	179	-74.6	-39.6	0	0	0	113.2
325	D	32.7	Very low	37.4	Very low	146 Å²	146	120.5 Å²	120.5	78%	0.781	64%	0.641	S	S	*	*			trans	-106.5	103	173.8	-75.4	-24.9	0	0	0	109.9	D323 H327	D323-D325 PolarHBondContact O-N 2.82Å; D325-H327 PolarHBondContact O-N 3.04Å
326	D	32.7	Very low	38.6	Very low	154 Å²	154	118.1 Å²	118.1	82%	0.824	63%	0.628	S	S	*	*			trans	-44.9	102.2	161.8	-84.5	-37.5	0	0	0	109.5
327	H	28.7	Very low	40.4	Very low	180 Å²	180	118.1 Å²	118.1	83%	0.833	63%	0.63	S	S	*	*			trans	160.7	111.5	141.3	-78.2	-46	0	0	0	108.6	D325	D325-H327 PolarHBondContact O-N 3.04Å
328	S	25.6	Very low	43	Very low	98 Å²	98	113.2 Å²	113.2	69%	0.685	61%	0.605	S	S	*	*			trans	134.3	134.2	135.2	74.5	0	0	0	0	117.8
329	F	29.7	Very low	46.1	Very low	182 Å²	182	107.9 Å²	107.9	80%	0.798	58%	0.579	S	S	*	*			trans	76.4	80.9	163.5	-47.6	-68.2	0	0	0	118.7	I331	F329-I331 PolarHBondContact O-N 2.9Å; F329-I331 VanDerWaalsContact O-N 3.13Å
330	I	26.2	Very low	49.4	Very low	165 Å²	165	101.9 Å²	101.9	85%	0.846	55%	0.548	S	S	*	.			trans	-58.3	106.1	150.3	-59.6	167.9	0	0	0	107.3	D332	I330-D332 PolarHBondContact O-N 3.19Å
331	I	36.9	Very low	52.6	Low	67 Å²	67	96 Å²	96	34%	0.344	52%	0.516	S	S	.	.			trans	-79.9	111.1	165.6	-60.9	175	0	0	0	105.8	I317 M318 F329 N333	I317-I331 WeakPolarHBondContact O-CD1 3.4Å; M318-I331 HydrophobicContact CB-CD1 3.95Å; F329-I331 PolarHBondContact O-N 2.9Å; F329-I331 VanDerWaalsContact O-N 3.13Å; I331-N333 PolarHBondContact O-N 2.8Å; I331-N333 VanDerWaalsContact O-N 3.09Å
332	D	36.9	Very low	55.7	Low	141 Å²	141	89.1 Å²	89.1	75%	0.754	48%	0.48	S	S	*	.			trans	-49.7	118.1	171.4	-103.1	-23.4	0	0	0	108.9	I330 G334	I330-D332 PolarHBondContact O-N 3.19Å; D332-G334 PolarHBondContact O-N 3.39Å
333	N	45.8	Very low	58.7	Low	160 Å²	160	85.3 Å²	85.3	86%	0.856	46%	0.455	S	S	*	.			trans	-67.9	47.3	173.2	-74	-28.9	0	0	0	111.5	I331	I331-N333 PolarHBondContact O-N 2.8Å; I331-N333 VanDerWaalsContact O-N 3.09Å
334	G	55.9	Low	61.7	Low	32 Å²	32	79 Å²	79	33%	0.33	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-61.7	146.7	173.9	0	0	0	0	0	110.3	D332 I336	D332-G334 PolarHBondContact O-N 3.39Å; G334-I336 PolarHBondContact O-N 3.04Å
335	P	66.1	Low	64.3	Low	64 Å²	64	75.4 Å²	75.4	42%	0.416	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-57.8	137.4	177	25.1	-33.5	0	0	0	109.9	K264 S337	K264-P335 HydrophobicContact CB-CB 4.18Å; K264-P335 HydrophobicContact CD-CB 4.26Å; K264-P335 HydrophobicContact CD-CG 3.85Å; K264-P335 HydrophobicContact CG-CB 4.31Å; K264-P335 HydrophobicContact CG-CG 4.31Å; P335-S337 PolarHBondContact O-N 3.32Å
336	I	80.9	Confident	67.1	Low	10 Å²	10	70.4 Å²	70.4	5%	0.051	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	126.5	-178.6	-64.8	134.1	0	0	0	108.7	K264 I265 I271 V311 F316 G334	K264-I336 CarbonylContact C-O 3.57Å; K264-I336 VanDerWaalsContact CA-O 3.31Å; K264-I336 WeakPolarHBondContact CA-O 3.4Å; I265-I336 HydrophobicContact CB-CB 4.09Å; I265-I336 HydrophobicContact CB-CG2 4.36Å; I265-I336 HydrophobicContact CD1-CG2 4.35Å; I265-I336 PolarHBondContact N-O 2.89Å; I265-I336 PolarHBondContact O-N 3.32Å; I271-I336 HydrophobicContact CD1-CD1 4.47Å; V311-I336 HydrophobicContact CB-CG2 4.33Å; F316-I336 HydrophobicContact CD2-CD1 4.05Å; F316-I336 HydrophobicContact CD2-CG1 3.94Å; F316-I336 HydrophobicContact CE1-CD1 3.88Å; F316-I336 HydrophobicContact CE2-CB 4.11Å; F316-I336 HydrophobicContact CE2-CD1 3.15Å; F316-I336 HydrophobicContact CE2-CG1 3.27Å; F316-I336 HydrophobicContact CE2-CG2 3.8Å; F316-I336 HydrophobicContact CZ-CD1 3.05Å; F316-I336 HydrophobicContact CZ-CG1 3.78Å; F316-I336 HydrophobicContact CZ-CG2 4.49Å; G334-I336 PolarHBondContact O-N 3.04Å
337	S	88.4	Confident	70	Confident	15 Å²	15	63.8 Å²	63.8	11%	0.105	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	146.7	175	45.3	0	0	0	0	110.7	N202 I263 V311 N312 P335	N202-S337 PolarHBondContact OD1-OG 3.37Å; I263-S337 WeakPolarHBondContact O-CA 3.28Å; V311-S337 CarbonylContact C-O 3.54Å; V311-S337 WeakPolarHBondContact CA-O 3.37Å; N312-S337 PolarHBondContact N-O 2.83Å; P335-S337 PolarHBondContact O-N 3.32Å
338	G	93.4	Very high	72.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	-170.7	171.6	0	0	0	0	0	111.8	I263 N310	I263-G338 VanDerWaalsContact CG1-C 3.44Å; I263-G338 WeakPolarHBondContact CG1-O 3.49Å; I263-G338 PolarHBondContact N-O 2.9Å; I263-G338 PolarHBondContact O-N 3.47Å; N310-G338 CarbonylContact O-C 3.49Å; N310-G338 WeakPolarHBondContact O-CA 3.47Å
339	I	96.6	Very high	75.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.5	174.6	-162.2	171.5	0	0	0	109.6	W205 P210 Y260 V261 R309 N310	W205-I339 HydrophobicContact CB-CB 4.13Å; W205-I339 HydrophobicContact CG-CB 3.88Å; W205-I339 HydrophobicContact CG-CG2 4.11Å; P210-I339 HydrophobicContact CB-CD1 4Å; Y260-I339 HydrophobicContact CD1-CD1 4.34Å; Y260-I339 HydrophobicContact CD1-CG1 4.32Å; V261-I339 WeakPolarHBondContact O-CA 3.36Å; V261-I339 WeakPolarHBondContact O-CG1 3.17Å; R309-I339 HydrophobicContact CB-CG2 4.13Å; R309-I339 WeakPolarHBondContact CB-O 3.45Å; R309-I339 PolarHBondContact N-O 3.04Å; N310-I339 HydrophobicContact CB-CG2 4.1Å; N310-I339 PolarHBondContact N-O 3.21Å; N310-I339 PolarHBondContact O-N 2.87Å
340	A	97.2	Very high	78.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.5	-179.6	0	0	0	0	0	111.3	Y260 V261 I263 I288 W307 I342	Y260-A340 CarbonylContact C-O 3.37Å; Y260-A340 VanDerWaalsContact CA-O 3.31Å; Y260-A340 WeakPolarHBondContact CA-O 3.29Å; V261-A340 PolarHBondContact N-O 3.04Å; V261-A340 PolarHBondContact O-N 3.44Å; I263-A340 HydrophobicContact CD1-CB 3.91Å; I263-A340 HydrophobicContact CG1-CB 4.26Å; I263-A340 HydrophobicContact CG2-CB 3.72Å; I288-A340 HydrophobicContact CD1-CB 3.7Å; W307-A340 WeakPolarHBondContact O-CA 3.06Å; W307-A340 WeakPolarHBondContact O-CB 3.49Å; A340-I342 HydrophobicContact CB-CG2 3.86Å
341	L	97.6	Very high	81.4	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	113.9	166.9	177.4	65.9	0	0	0	107.7	I217 E225 R258 Y260 G306 W307 R309	I217-L341 HydrophobicContact CD1-CD2 3.47Å; I217-L341 VanDerWaalsContact CD1-CD2 3.47Å; I217-L341 HydrophobicContact CG1-CD2 4.37Å; E225-L341 HydrophobicContact CB-CD1 3.98Å; E225-L341 HydrophobicContact CG-CD1 4.22Å; R258-L341 HydrophobicContact CB-CD1 3.88Å; R258-L341 HydrophobicContact CB-CG 4.44Å; Y260-L341 HydrophobicContact CD1-CB 4.41Å; Y260-L341 HydrophobicContact CD2-CD1 3.91Å; Y260-L341 HydrophobicContact CE1-CB 4.24Å; Y260-L341 HydrophobicContact CE2-CB 4.37Å; Y260-L341 HydrophobicContact CE2-CD1 3.89Å; Y260-L341 HydrophobicContact CE2-CG 4.49Å; Y260-L341 HydrophobicContact CG-CD1 4.47Å; G306-L341 CarbonylContact C-O 3.56Å; G306-L341 WeakPolarHBondContact CA-O 3.34Å; W307-L341 PolarHBondContact N-O 2.87Å; W307-L341 PolarHBondContact O-N 2.89Å; R309-L341 HydrophobicContact CG-CB 4.28Å
342	I	96.5	Very high	83.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	153.2	-177.4	69.2	172.9	0	0	0	111.8	R258 R259 V261 I288 A340 L344 A347 P376	R258-I342 WeakPolarHBondContact CA-O 3.45Å; R258-I342 WeakPolarHBondContact CB-O 3.12Å; R259-I342 PolarHBondContact N-O 3.4Å; R259-I342 VanDerWaalsContact N-O 3.11Å; R259-I342 PolarHBondContact O-N 3.28Å; V261-I342 HydrophobicContact CB-CD1 4.31Å; V261-I342 HydrophobicContact CB-CG1 4.43Å; V261-I342 HydrophobicContact CG1-CD1 4.11Å; V261-I342 HydrophobicContact CG1-CG1 3.97Å; V261-I342 HydrophobicContact CG2-CD1 3.29Å; V261-I342 HydrophobicContact CG2-CG1 3.58Å; V261-I342 HydrophobicContact CG2-CG2 4.38Å; I288-I342 HydrophobicContact CD1-CG2 3.79Å; A340-I342 HydrophobicContact CB-CG2 3.86Å; I342-L344 HydrophobicContact CG1-CD2 4.39Å; I342-A347 HydrophobicContact CD1-CB 3.56Å; I342-A347 HydrophobicContact CG1-CB 4.4Å; I342-P376 HydrophobicContact CD1-CB 3.62Å; I342-P376 HydrophobicContact CD1-CG 4.05Å
343	R	95.5	Very high	86.5	Confident	55 Å²	55	48.3 Å²	48.3	21%	0.208	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.3	164.9	-70.2	178.5	-180	179.1	-0.3	110.6	R257 R258 I305 E346 A347	R257-R343 VanDerWaalsContact O-CA 3.28Å; R257-R343 WeakPolarHBondContact O-CA 3.3Å; R258-R343 HydrophobicContact CG-CB 4.23Å; R258-R343 HydrophobicContact CG-CG 3.45Å; R258-R343 VanDerWaalsContact CG-CG 3.45Å; R258-R343 VanDerWaalsContact NE-CG 3.33Å; I305-R343 VanDerWaalsContact O-CG 3.29Å; I305-R343 WeakPolarHBondContact O-CG 3.3Å; I305-R343 PolarHBondContact O-N 2.86Å; R343-E346 WeakPolarHBondContact CB-OE2 3.46Å; R343-E346 WeakPolarHBondContact CD-OE1 3.33Å; R343-E346 WeakPolarHBondContact CD-OE2 3.44Å; R343-E346 IonicContact CZ-OE1 3.22Å; R343-E346 IonicContact NE-OE1 2.72Å; R343-E346 IonicContact NH1-OE1 3.78Å; R343-E346 PolarHBondContact NH1-OE1 3.03Å; R343-A347 WeakPolarHBondContact O-CB 3.41Å; R343-A347 PolarHBondContact O-N 3.29Å; R343-A347 VanDerWaalsContact O-N 3.14Å
344	L	94.9	Very high	88.8	Confident	15 Å²	15	41.2 Å²	41.2	8%	0.079	22%	0.216	C	C	.	.	H	α-helix	trans	-72.8	-36.6	-172.1	-61.7	178.6	0	0	0	112.7	R257 R259 V261 I342 S348 I386 A387 I390	R257-L344 PolarHBondContact O-N 2.88Å; R259-L344 HydrophobicContact CB-CD1 4.39Å; R259-L344 HydrophobicContact CB-CD2 4.31Å; R259-L344 HydrophobicContact CG-CD1 4.01Å; V261-L344 HydrophobicContact CG1-CD2 4.02Å; I342-L344 HydrophobicContact CG1-CD2 4.39Å; L344-S348 VanDerWaalsContact O-CB 3.3Å; L344-S348 WeakPolarHBondContact O-CB 3.29Å; L344-S348 PolarHBondContact O-N 3.45Å; L344-S348 VanDerWaalsContact O-N 3.13Å; L344-S348 PolarHBondContact O-OG 3.23Å; L344-I386 HydrophobicContact CD1-CG2 4.42Å; L344-A387 HydrophobicContact CB-CB 4.44Å; L344-A387 HydrophobicContact CD1-CB 4.36Å; L344-A387 HydrophobicContact CD2-CB 4.14Å; L344-I390 HydrophobicContact CD2-CD1 4.39Å
345	T	92.4	Very high	90.5	Very high	97 Å²	97	39.7 Å²	39.7	60%	0.595	20%	0.2	S	C	*	.	H	α-helix	trans	-65	-54	-179.6	-54.9	0	0	0	0	111	A347 S348	T345-A347 VanDerWaalsContact C-N 3.34Å; T345-A347 PolarHBondContact O-N 3.37Å; T345-S348 WeakPolarHBondContact O-CB 3.1Å; T345-S348 PolarHBondContact O-N 3.35Å; T345-S348 VanDerWaalsContact O-N 3.13Å
346	E	91.6	Very high	91.7	Very high	41 Å²	41	36.7 Å²	36.7	19%	0.192	18%	0.181	C	C	.	.	H	α-helix	trans	-64.5	-38.4	179	-66.3	93.3	140.1	0	0	111.9	Q290 I305 R343 S348 E349	Q290-E346 PolarHBondContact NE2-O 3.34Å; I305-E346 HydrophobicContact CB-CB 4.28Å; I305-E346 HydrophobicContact CD1-CB 4.32Å; I305-E346 HydrophobicContact CG2-CB 3.84Å; I305-E346 HydrophobicContact CG2-CG 4.07Å; R343-E346 WeakPolarHBondContact CB-OE2 3.46Å; R343-E346 WeakPolarHBondContact CD-OE1 3.33Å; R343-E346 WeakPolarHBondContact CD-OE2 3.44Å; R343-E346 IonicContact CZ-OE1 3.22Å; R343-E346 IonicContact NE-OE1 2.72Å; R343-E346 IonicContact NH1-OE1 3.78Å; R343-E346 PolarHBondContact NH1-OE1 3.03Å; E346-S348 PolarHBondContact O-N 3.12Å; E346-E349 PolarHBondContact O-N 3.16Å
347	A	92.2	Very high	92	Very high	16 Å²	16	39.3 Å²	39.3	13%	0.132	20%	0.195	C	C	.	.	H	α-helix	trans	-68.9	-12.7	176.4	0	0	0	0	0	114.6	I342 R343 T345 L354 P376 I390	I342-A347 HydrophobicContact CD1-CB 3.56Å; I342-A347 HydrophobicContact CG1-CB 4.4Å; R343-A347 WeakPolarHBondContact O-CB 3.41Å; R343-A347 PolarHBondContact O-N 3.29Å; R343-A347 VanDerWaalsContact O-N 3.14Å; T345-A347 VanDerWaalsContact C-N 3.34Å; T345-A347 PolarHBondContact O-N 3.37Å; A347-L354 HydrophobicContact CB-CD1 3.98Å; A347-P376 HydrophobicContact CB-CG 4.39Å; A347-I390 HydrophobicContact CB-CD1 4.02Å
348	S	90.4	Very high	91.8	Very high	23 Å²	23	38.6 Å²	38.6	16%	0.161	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-11	178.6	-71.9	0	0	0	0	113.9	L344 T345 E346 Q350 T389 I390	L344-S348 VanDerWaalsContact O-CB 3.3Å; L344-S348 WeakPolarHBondContact O-CB 3.29Å; L344-S348 PolarHBondContact O-N 3.45Å; L344-S348 VanDerWaalsContact O-N 3.13Å; L344-S348 PolarHBondContact O-OG 3.23Å; T345-S348 WeakPolarHBondContact O-CB 3.1Å; T345-S348 PolarHBondContact O-N 3.35Å; T345-S348 VanDerWaalsContact O-N 3.13Å; E346-S348 PolarHBondContact O-N 3.12Å; S348-Q350 PolarHBondContact O-N 3.12Å; S348-Q350 VanDerWaalsContact O-N 3.11Å; S348-T389 WeakPolarHBondContact CB-OG1 3.23Å; S348-T389 PolarHBondContact OG-OG1 3.01Å; S348-I390 WeakPolarHBondContact OG-CG1 3.43Å
349	E	89.8	Confident	91	Very high	62 Å²	62	41.4 Å²	41.4	29%	0.29	21%	0.208	S	C	.	.			trans	-78.3	96.7	-176.3	-62.7	178.1	171.7	0	0	110.5	Q290 K301 E346 Q351 Y352	Q290-E349 PolarHBondContact NE2-OE2 3.16Å; Q290-E349 PolarHBondContact OE1-OE2 3.34Å; K301-E349 IonicContact NZ-OE1 3.48Å; K301-E349 IonicContact NZ-OE2 3.94Å; K301-E349 PolarHBondContact NZ-OE2 2.73Å; E346-E349 PolarHBondContact O-N 3.16Å; E349-Q351 PolarHBondContact O-N 3.27Å; E349-Y352 HydrophobicContact CB-CD2 3.62Å; E349-Y352 HydrophobicContact CB-CE2 4.21Å; E349-Y352 HydrophobicContact CG-CD2 4.44Å; E349-Y352 PolarHBondContact O-N 3.13Å; E349-Y352 WeakPolarHBondContact OE2-CD2 3.19Å; E349-Y352 WeakPolarHBondContact OE2-CE2 3.31Å
350	Q	85	Confident	89.8	Confident	173 Å²	173	42.3 Å²	42.3	81%	0.808	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.2	-174.8	-64.7	-175.6	-18	0	0	115.6	S348 Y352	S348-Q350 PolarHBondContact O-N 3.12Å; S348-Q350 VanDerWaalsContact O-N 3.11Å; Q350-Y352 PolarHBondContact O-N 2.88Å
351	Q	86.2	Confident	88.3	Confident	130 Å²	130	47.2 Å²	47.2	61%	0.607	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-6.1	178.9	42.5	-179.7	-18.2	0	0	113.4	E349	E349-Q351 PolarHBondContact O-N 3.27Å
352	Y	89.6	Confident	86.3	Confident	61 Å²	61	49.9 Å²	49.9	24%	0.239	25%	0.252	C	S	.	.	S	Bend	trans	-123.5	153.4	179.8	-58.8	-67.9	0	0	0	111.3	Q290 V291 L298 E349 Q350	Q290-Y352 VanDerWaalsContact CG-CB 3.44Å; Q290-Y352 HydrophobicContact CG-CD1 4.44Å; Q290-Y352 HydrophobicContact CG-CD2 4.26Å; Q290-Y352 HydrophobicContact CG-CG 3.81Å; V291-Y352 CarbonylContact O-C 3.49Å; V291-Y352 VanDerWaalsContact O-CA 3.29Å; V291-Y352 WeakPolarHBondContact O-CA 3.36Å; V291-Y352 VanDerWaalsContact O-CB 3.3Å; V291-Y352 WeakPolarHBondContact O-CB 3.43Å; L298-Y352 HydrophobicContact CD1-CD1 3.83Å; L298-Y352 HydrophobicContact CD1-CE1 3.49Å; L298-Y352 VanDerWaalsContact CD1-CE1 3.49Å; L298-Y352 HydrophobicContact CD2-CE1 4.26Å; L298-Y352 HydrophobicContact CG-CE1 4.44Å; E349-Y352 HydrophobicContact CB-CD2 3.62Å; E349-Y352 HydrophobicContact CB-CE2 4.21Å; E349-Y352 HydrophobicContact CG-CD2 4.44Å; E349-Y352 PolarHBondContact O-N 3.13Å; E349-Y352 WeakPolarHBondContact OE2-CD2 3.19Å; E349-Y352 WeakPolarHBondContact OE2-CE2 3.31Å; Q350-Y352 PolarHBondContact O-N 2.88Å
353	K	91.2	Very high	84.4	Confident	59 Å²	59	57.8 Å²	57.8	26%	0.257	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	155.7	170.6	-63.6	-177.8	-177.4	179	0	110.2	Q290 V291 H295	Q290-K353 WeakPolarHBondContact CA-O 3.46Å; V291-K353 HydrophobicContact CG2-CB 4.1Å; V291-K353 PolarHBondContact N-O 3.04Å; V291-K353 PolarHBondContact O-N 3.21Å; H295-K353 VanDerWaalsContact CE1-CD 3.43Å; H295-K353 WeakPolarHBondContact CE1-CD 3.39Å; H295-K353 PolarHBondContact NE2-NZ 3.2Å
354	L	93.2	Very high	82.5	Confident	10 Å²	10	65.4 Å²	65.4	5%	0.052	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.7	174.1	-51.4	-175.4	0	0	0	109	I288 Y289 Q290 I305 A347 E373 I374 P376	I288-L354 HydrophobicContact CG2-CB 3.96Å; Y289-L354 CarbonylContact O-C 3.48Å; Y289-L354 WeakPolarHBondContact O-CA 3.44Å; Q290-L354 HydrophobicContact CB-CD2 4.18Å; Q290-L354 HydrophobicContact CG-CD2 4.14Å; I305-L354 HydrophobicContact CD1-CD1 3.98Å; I305-L354 HydrophobicContact CD1-CD2 3.4Å; I305-L354 HydrophobicContact CD1-CG 4.27Å; A347-L354 HydrophobicContact CB-CD1 3.98Å; L354-E373 WeakPolarHBondContact O-CA 3.45Å; L354-I374 HydrophobicContact CB-CB 4.16Å; L354-I374 WeakPolarHBondContact CB-O 3.12Å; L354-I374 PolarHBondContact O-N 3.28Å; L354-P376 HydrophobicContact CD1-CG 3.89Å
355	I	91.8	Very high	80.5	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.005	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	157.1	-176.8	64	162.9	0	0	0	111.6	I288 Y289 V291 Q371 L372	I288-I355 WeakPolarHBondContact CA-O 3.49Å; Y289-I355 PolarHBondContact N-O 3.04Å; Y289-I355 PolarHBondContact O-N 3.22Å; V291-I355 HydrophobicContact CB-CD1 4.28Å; V291-I355 HydrophobicContact CB-CG1 4.48Å; V291-I355 HydrophobicContact CG1-CD1 3.33Å; V291-I355 HydrophobicContact CG1-CG1 3.73Å; V291-I355 HydrophobicContact CG2-CB 4.36Å; V291-I355 HydrophobicContact CG2-CD1 3.99Å; V291-I355 HydrophobicContact CG2-CG1 3.93Å; V291-I355 HydrophobicContact CG2-CG2 3.6Å; I355-Q371 HydrophobicContact CB-CG 4.08Å; I355-Q371 HydrophobicContact CD1-CG 4.3Å; I355-Q371 HydrophobicContact CG2-CG 4.13Å; I355-L372 CarbonylContact C-O 3.6Å; I355-L372 WeakPolarHBondContact CA-O 3.46Å
356	V	90.5	Very high	78.8	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.5	166	173.9	0	0	0	0	108	A286 I288 I308 I358 Q371 L372 I374	A286-V356 HydrophobicContact CB-CG1 3.46Å; A286-V356 VanDerWaalsContact CB-CG1 3.46Å; I288-V356 HydrophobicContact CB-CG2 4.17Å; I288-V356 HydrophobicContact CG1-CG2 3.51Å; I308-V356 HydrophobicContact CD1-CB 4.27Å; I308-V356 HydrophobicContact CD1-CG1 4.22Å; I308-V356 HydrophobicContact CD1-CG2 3.79Å; I308-V356 HydrophobicContact CG1-CG2 4.1Å; V356-I358 HydrophobicContact CG1-CD1 3.46Å; V356-I358 VanDerWaalsContact CG1-CD1 3.46Å; V356-I358 HydrophobicContact CG1-CG1 4.06Å; V356-Q371 WeakPolarHBondContact O-CA 3.13Å; V356-L372 PolarHBondContact N-O 3.32Å; V356-L372 PolarHBondContact O-N 2.86Å; V356-I374 HydrophobicContact CB-CD1 4.46Å; V356-I374 HydrophobicContact CB-CG1 4.44Å; V356-I374 HydrophobicContact CG2-CD1 4.02Å; V356-I374 HydrophobicContact CG2-CG1 3.72Å
357	N	87.5	Confident	77.3	Confident	65 Å²	65	77.1 Å²	77.1	35%	0.348	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	117	172.8	-65.8	-21.2	0	0	0	108.4	I370	N357-I370 WeakPolarHBondContact CA-O 3.19Å
358	I	83.9	Confident	76.3	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.005	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	118.8	176.5	-57.5	-58.3	0	0	0	108.4	L274 I283 A286 V356 L360 A369 I370 L372	L274-I358 HydrophobicContact CD2-CB 4Å; L274-I358 HydrophobicContact CD2-CG1 4.36Å; L274-I358 HydrophobicContact CD2-CG2 3.69Å; I283-I358 HydrophobicContact CB-CD1 4.23Å; I283-I358 HydrophobicContact CG1-CD1 4.04Å; I283-I358 HydrophobicContact CG1-CG1 4.47Å; A286-I358 HydrophobicContact CB-CD1 3.69Å; V356-I358 HydrophobicContact CG1-CD1 3.46Å; V356-I358 VanDerWaalsContact CG1-CD1 3.46Å; V356-I358 HydrophobicContact CG1-CG1 4.06Å; I358-L360 PolarHBondContact O-N 3.08Å; I358-A369 CarbonylContact O-C 3.52Å; I358-A369 VanDerWaalsContact O-CA 3.26Å; I358-A369 WeakPolarHBondContact O-CA 3.5Å; I358-I370 PolarHBondContact N-O 3.43Å; I358-I370 PolarHBondContact O-N 2.85Å; I358-L372 HydrophobicContact CG1-CD1 3.9Å
359	P	78.4	Confident	75.7	Confident	59 Å²	59	80 Å²	80	38%	0.383	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	133.6	175	27.2	-32.9	0	0	0	110.1
360	L	71	Confident	75.2	Confident	19 Å²	19	77.9 Å²	77.9	10%	0.099	40%	0.398	C	S	.	.			trans	-92.6	108.7	168.2	-73.6	172.7	0	0	0	107.9	A273 I358 T362 S368 I370	A273-L360 HydrophobicContact CB-CD1 4.09Å; A273-L360 HydrophobicContact CB-CD2 3.73Å; A273-L360 WeakPolarHBondContact O-CD2 3.35Å; I358-L360 PolarHBondContact O-N 3.08Å; L360-T362 HydrophobicContact CB-CG2 4.48Å; L360-T362 PolarHBondContact O-N 3.32Å; L360-S368 WeakPolarHBondContact CB-O 3.44Å; L360-S368 WeakPolarHBondContact CB-OG 3.14Å; L360-S368 PolarHBondContact N-O 2.91Å; L360-I370 HydrophobicContact CD1-CD1 3.83Å; L360-I370 HydrophobicContact CD1-CG1 3.63Å; L360-I370 HydrophobicContact CD2-CD1 3.62Å; L360-I370 HydrophobicContact CD2-CG1 4.14Å; L360-I370 HydrophobicContact CG-CD1 3.91Å; L360-I370 HydrophobicContact CG-CG1 3.85Å
361	H	64.4	Low	75.2	Confident	102 Å²	102	72.1 Å²	72.1	47%	0.472	37%	0.371	S	S	.	.			trans	-83.3	88.3	165.6	-72.8	-68.2	0	0	0	107.9	I278	I278-H361 HydrophobicContact CG2-CB 4.14Å
362	T	56.9	Low	75.3	Confident	58 Å²	58	66 Å²	66	36%	0.356	34%	0.343	S	S	.	.			trans	-101.5	150.6	165	62.4	0	0	0	0	109.2	L360 Y364 D365	L360-T362 HydrophobicContact CB-CG2 4.48Å; L360-T362 PolarHBondContact O-N 3.32Å; T362-Y364 PolarHBondContact O-N 3.36Å; T362-D365 PolarHBondContact OG1-N 3.14Å
363	D	56.7	Low	75.3	Confident	166 Å²	166	65 Å²	65	89%	0.888	34%	0.34	S	S	*	.	S	Bend	trans	-59.9	-13.2	-180	-67.1	-37.3	0	0	0	113.7
364	Y	55.7	Low	75.4	Confident	215 Å²	215	62.4 Å²	62.4	84%	0.843	33%	0.329	S	S	*	.	S	Bend	trans	-111.6	-25.8	-171.7	-68.2	-79.7	0	0	0	115	T362	T362-Y364 PolarHBondContact O-N 3.36Å
365	D	52.7	Low	75.4	Confident	107 Å²	107	65.2 Å²	65.2	57%	0.572	34%	0.344	S	S	*	.			trans	-145.1	99.2	-176.6	-97.8	-32.8	0	0	0	112.7	T362 N367 S368	T362-D365 PolarHBondContact OG1-N 3.14Å; D365-N367 PolarHBondContact O-N 3.31Å; D365-N367 VanDerWaalsContact O-N 3.16Å; D365-S368 PolarHBondContact O-OG 2.84Å
366	N	55.9	Low	75.6	Confident	134 Å²	134	65.9 Å²	65.9	72%	0.717	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-9.4	177.1	-84.3	-25.6	0	0	0	114.7
367	N	60.3	Low	75.8	Confident	158 Å²	158	66.3 Å²	66.3	85%	0.845	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	1.4	-174.4	-80	-8.5	0	0	0	114.4	D365	D365-N367 PolarHBondContact O-N 3.31Å; D365-N367 VanDerWaalsContact O-N 3.16Å
368	S	71.6	Confident	76.3	Confident	38 Å²	38	63.2 Å²	63.2	27%	0.266	33%	0.333	S	S	.	.			trans	-76.2	131.5	176.4	58.8	0	0	0	0	109.9	L360 D365	L360-S368 WeakPolarHBondContact CB-O 3.44Å; L360-S368 WeakPolarHBondContact CB-OG 3.14Å; L360-S368 PolarHBondContact N-O 2.91Å; D365-S368 PolarHBondContact O-OG 2.84Å
369	A	77.2	Confident	76.8	Confident	61 Å²	61	63.2 Å²	63.2	50%	0.504	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139.7	176	0	0	0	0	0	109.4	I358	I358-A369 CarbonylContact O-C 3.52Å; I358-A369 VanDerWaalsContact O-CA 3.26Å; I358-A369 WeakPolarHBondContact O-CA 3.5Å
370	I	80.3	Confident	77.5	Confident	18 Å²	18	62.8 Å²	62.8	9%	0.092	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	126.6	173	-66.5	173.6	0	0	0	108.3	A273 L274 N357 I358 L360 L372	A273-I370 HydrophobicContact CB-CD1 3.89Å; L274-I370 HydrophobicContact CD1-CD1 4.46Å; L274-I370 HydrophobicContact CD1-CG2 4.24Å; L274-I370 HydrophobicContact CD2-CB 4.38Å; L274-I370 HydrophobicContact CD2-CD1 3.9Å; L274-I370 HydrophobicContact CG-CD1 3.63Å; L274-I370 HydrophobicContact CG-CG2 4.42Å; N357-I370 WeakPolarHBondContact CA-O 3.19Å; I358-I370 PolarHBondContact N-O 3.43Å; I358-I370 PolarHBondContact O-N 2.85Å; L360-I370 HydrophobicContact CD1-CD1 3.83Å; L360-I370 HydrophobicContact CD1-CG1 3.63Å; L360-I370 HydrophobicContact CD2-CD1 3.62Å; L360-I370 HydrophobicContact CD2-CG1 4.14Å; L360-I370 HydrophobicContact CG-CD1 3.91Å; L360-I370 HydrophobicContact CG-CG1 3.85Å; I370-L372 HydrophobicContact CG2-CD2 3.83Å; I370-L372 HydrophobicContact CG2-CG 4.13Å
371	Q	84.3	Confident	78.6	Confident	53 Å²	53	64.4 Å²	64.4	25%	0.248	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	125.5	171	-170.8	174.2	22.6	0	0	109.7	H295 I355 V356	H295-Q371 PolarHBondContact ND1-NE2 3.15Å; I355-Q371 HydrophobicContact CB-CG 4.08Å; I355-Q371 HydrophobicContact CD1-CG 4.3Å; I355-Q371 HydrophobicContact CG2-CG 4.13Å; V356-Q371 WeakPolarHBondContact O-CA 3.13Å
372	L	87.6	Confident	80.2	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129	176.7	-63.7	177.9	0	0	0	109.1	I265 L274 I283 I355 V356 I358 I370	I265-L372 HydrophobicContact CG2-CB 3.82Å; I265-L372 HydrophobicContact CG2-CD1 3.99Å; I265-L372 HydrophobicContact CG2-CD2 4.19Å; I265-L372 HydrophobicContact CG2-CG 4.23Å; L274-L372 HydrophobicContact CD1-CD1 3.89Å; L274-L372 HydrophobicContact CD1-CD2 3.87Å; L274-L372 HydrophobicContact CD1-CG 4.32Å; I283-L372 HydrophobicContact CD1-CD1 3.92Å; I355-L372 CarbonylContact C-O 3.6Å; I355-L372 WeakPolarHBondContact CA-O 3.46Å; V356-L372 PolarHBondContact N-O 3.32Å; V356-L372 PolarHBondContact O-N 2.86Å; I358-L372 HydrophobicContact CG1-CD1 3.9Å; I370-L372 HydrophobicContact CG2-CD2 3.83Å; I370-L372 HydrophobicContact CG2-CG 4.13Å
373	E	89.9	Confident	82	Confident	39 Å²	39	59.8 Å²	59.8	18%	0.182	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	132.1	171.6	-175.3	173.2	-169.9	0	0	110	I265 V266 M268 L354 I375	I265-E373 WeakPolarHBondContact CA-O 3.44Å; V266-E373 HydrophobicContact CB-CB 4.4Å; V266-E373 PolarHBondContact N-O 3.22Å; V266-E373 PolarHBondContact O-N 2.94Å; M268-E373 HydrophobicContact CE-CB 3.73Å; M268-E373 HydrophobicContact CE-CG 4.19Å; M268-E373 WeakPolarHBondContact CE-OE2 2.99Å; M268-E373 HydrophobicContact SD-CB 4.33Å; L354-E373 WeakPolarHBondContact O-CA 3.45Å; E373-I375 HydrophobicContact CG-CG1 4.3Å
374	I	93	Very high	83.8	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.021	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	119.6	-179.3	-51.3	-57.8	0	0	0	108.9	I263 I265 I288 I308 L354 V356 P376	I263-I374 HydrophobicContact CB-CG2 3.84Å; I263-I374 HydrophobicContact CD1-CG2 3.98Å; I263-I374 HydrophobicContact CG2-CG2 3.66Å; I265-I374 HydrophobicContact CB-CD1 4.32Å; I265-I374 HydrophobicContact CD1-CD1 4.06Å; I265-I374 HydrophobicContact CG1-CD1 3.74Å; I265-I374 HydrophobicContact CG2-CD1 4.03Å; I288-I374 HydrophobicContact CD1-CG2 4.37Å; I288-I374 HydrophobicContact CG1-CG1 4.49Å; I308-I374 HydrophobicContact CD1-CD1 3.9Å; L354-I374 HydrophobicContact CB-CB 4.16Å; L354-I374 WeakPolarHBondContact CB-O 3.12Å; L354-I374 PolarHBondContact O-N 3.28Å; V356-I374 HydrophobicContact CB-CD1 4.46Å; V356-I374 HydrophobicContact CB-CG1 4.44Å; V356-I374 HydrophobicContact CG2-CD1 4.02Å; V356-I374 HydrophobicContact CG2-CG1 3.72Å; I374-P376 WeakPolarHBondContact O-CD 3.48Å
375	I	93.8	Very high	85.5	Confident	70 Å²	70	51.1 Å²	51.1	36%	0.359	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	98	179.4	-54.9	174.9	0	0	0	108	K264 V266 E373	K264-I375 HydrophobicContact CB-CB 4.26Å; K264-I375 PolarHBondContact N-O 2.86Å; K264-I375 PolarHBondContact O-N 3.11Å; V266-I375 HydrophobicContact CG2-CD1 3.71Å; E373-I375 HydrophobicContact CG-CG1 4.3Å
376	P	96.1	Very high	87.4	Confident	15 Å²	15	47 Å²	47	10%	0.097	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	150.1	174.6	31.1	-34.3	0	0	0	110.7	V261 P262 I263 I342 A347 L354 I374 I390	V261-P376 HydrophobicContact CG2-CB 3.89Å; P262-P376 WeakPolarHBondContact O-CA 3.2Å; I263-P376 HydrophobicContact CG2-CB 4.3Å; I342-P376 HydrophobicContact CD1-CB 3.62Å; I342-P376 HydrophobicContact CD1-CG 4.05Å; A347-P376 HydrophobicContact CB-CG 4.39Å; L354-P376 HydrophobicContact CD1-CG 3.89Å; I374-P376 WeakPolarHBondContact O-CD 3.48Å; P376-I390 HydrophobicContact CB-CG2 4.47Å; P376-I390 HydrophobicContact CG-CG2 4.46Å
377	Y	95.6	Very high	89.2	Confident	9 Å²	9	41.1 Å²	41.1	4%	0.035	24%	0.242	C	C	.	.			trans	-142.9	155.8	172.3	61.2	-87.5	0	0	0	110.8	P262 K264 K391 I393	P262-Y377 HydrophobicContact CB-CD1 3.96Å; P262-Y377 HydrophobicContact CB-CD2 3.71Å; P262-Y377 HydrophobicContact CB-CE1 3.48Å; P262-Y377 VanDerWaalsContact CB-CE1 3.48Å; P262-Y377 HydrophobicContact CB-CE2 3.23Å; P262-Y377 HydrophobicContact CB-CG 4.07Å; P262-Y377 WeakPolarHBondContact CB-OH 3.34Å; P262-Y377 VanDerWaalsContact CD-O 3.25Å; P262-Y377 WeakPolarHBondContact CD-O 3.42Å; P262-Y377 HydrophobicContact CG-CD2 3.91Å; P262-Y377 HydrophobicContact CG-CE2 3.65Å; P262-Y377 WeakPolarHBondContact CG-O 3.25Å; P262-Y377 PolarHBondContact O-N 3.43Å; P262-Y377 VanDerWaalsContact O-N 3.11Å; K264-Y377 HydrophobicContact CD-CE1 4.5Å; K264-Y377 HydrophobicContact CG-CD1 4.24Å; K264-Y377 HydrophobicContact CG-CE1 3.86Å; Y377-K391 CarbonylContact C-O 3.49Å; Y377-K391 VanDerWaalsContact CA-O 3.28Å; Y377-K391 WeakPolarHBondContact CA-O 3.33Å; Y377-K391 WeakPolarHBondContact CB-O 3.38Å; Y377-I393 HydrophobicContact CD1-CD1 3.97Å; Y377-I393 HydrophobicContact CD2-CB 3.9Å; Y377-I393 HydrophobicContact CD2-CD1 3.4Å; Y377-I393 VanDerWaalsContact CD2-CD1 3.4Å; Y377-I393 HydrophobicContact CD2-CG1 3.67Å; Y377-I393 HydrophobicContact CE1-CD1 4.32Å; Y377-I393 HydrophobicContact CE2-CB 4.33Å; Y377-I393 HydrophobicContact CE2-CD1 3.78Å; Y377-I393 HydrophobicContact CE2-CG1 4.35Å; Y377-I393 HydrophobicContact CG-CD1 3.48Å; Y377-I393 VanDerWaalsContact CG-CD1 3.48Å; Y377-I393 HydrophobicContact CG-CG1 3.94Å
378	I	96.5	Very high	90.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129	-179.3	-58.3	-59.1	0	0	0	109.9	V261 W382 A387 I390 K391 R392 I393	V261-I378 HydrophobicContact CG1-CD1 4.14Å; I378-W382 HydrophobicContact CD1-CE3 4.14Å; I378-W382 HydrophobicContact CD1-CZ3 3.94Å; I378-W382 HydrophobicContact CG2-CB 3.88Å; I378-W382 HydrophobicContact CG2-CD2 4.01Å; I378-W382 HydrophobicContact CG2-CE3 3.75Å; I378-W382 HydrophobicContact CG2-CG 4.1Å; I378-A387 HydrophobicContact CD1-CB 4.01Å; I378-A387 HydrophobicContact CG1-CB 4.08Å; I378-I390 HydrophobicContact CD1-CB 4.46Å; I378-I390 HydrophobicContact CD1-CD1 4.48Å; I378-I390 HydrophobicContact CD1-CG2 4.31Å; I378-I390 HydrophobicContact CG1-CB 3.78Å; I378-I390 HydrophobicContact CG1-CG2 3.77Å; I378-K391 PolarHBondContact N-O 2.65Å; I378-R392 HydrophobicContact CB-CG 3.93Å; I378-R392 HydrophobicContact CG2-CG 4.23Å; I378-R392 CarbonylContact O-C 3.48Å; I378-R392 WeakPolarHBondContact O-CA 3.22Å; I378-I393 PolarHBondContact O-N 3.25Å
379	P	95.7	Very high	91.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	140.3	173.5	-22	34.1	0	0	0	111.3	E206 L207 P262 W381 W382 R392	E206-P379 WeakPolarHBondContact O-CG 3.42Å; L207-P379 VanDerWaalsContact C-CG 3.47Å; L207-P379 WeakPolarHBondContact O-CG 3.4Å; P262-P379 HydrophobicContact CG-CG 3.68Å; P379-W381 HydrophobicContact CB-CG 4.37Å; P379-W381 PolarHBondContact O-N 2.8Å; P379-W381 VanDerWaalsContact O-N 3.13Å; P379-W382 HydrophobicContact CB-CG 4.43Å; P379-W382 HydrophobicContact CG-CG 4.47Å; P379-W382 WeakPolarHBondContact O-CB 3.19Å; P379-W382 PolarHBondContact O-N 3.31Å; P379-W382 VanDerWaalsContact O-N 3.13Å; P379-R392 PolarHBondContact O-NH1 2.93Å
380	S	93.1	Very high	92.4	Very high	50 Å²	50	37.5 Å²	37.5	35%	0.35	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-21.4	-179	56.9	0	0	0	0	114.4	W382 I393 C395	S380-W382 VanDerWaalsContact C-N 3.28Å; S380-W382 PolarHBondContact O-N 3.13Å; S380-I393 WeakPolarHBondContact CB-O 3.26Å; S380-I393 PolarHBondContact N-O 3.09Å; S380-I393 PolarHBondContact OG-O 3.22Å; S380-C395 PolarHBondContact OG-N 3.07Å
381	W	94.4	Very high	93	Very high	54 Å²	54	44.2 Å²	44.2	21%	0.205	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.7	178.7	77	-90	0	0	0	113.6	I168 L207 L209 L230 P379	I168-W381 HydrophobicContact CD1-CB 4.06Å; I168-W381 HydrophobicContact CD1-CG 4.49Å; I168-W381 HydrophobicContact CG1-CB 3.57Å; I168-W381 HydrophobicContact CG1-CG 3.9Å; L207-W381 WeakPolarHBondContact O-CZ2 3.4Å; L207-W381 PolarHBondContact O-NE1 2.87Å; L209-W381 HydrophobicContact CD2-CH2 4.4Å; L209-W381 HydrophobicContact CD2-CZ2 3.98Å; L230-W381 HydrophobicContact CB-CH2 3.7Å; L230-W381 HydrophobicContact CB-CZ3 3.92Å; L230-W381 WeakPolarHBondContact O-CZ3 3.3Å; P379-W381 HydrophobicContact CB-CG 4.37Å; P379-W381 PolarHBondContact O-N 2.8Å; P379-W381 VanDerWaalsContact O-N 3.13Å
382	W	96.4	Very high	93.4	Very high	6 Å²	6	45.3 Å²	45.3	2%	0.023	25%	0.249	C	C	.	.	S	Bend	trans	-71	145	175.9	-72.8	24.8	0	0	0	110.6	L207 N227 L230 R259 Y260 V261 I378 P379 S380 I386 R392	L207-W382 PolarHBondContact O-NE1 2.9Å; N227-W382 HydrophobicContact CB-CZ2 4.45Å; N227-W382 VanDerWaalsContact ND2-CZ2 3.27Å; N227-W382 WeakPolarHBondContact ND2-CZ2 3.21Å; N227-W382 WeakPolarHBondContact OD1-CH2 3.18Å; L230-W382 HydrophobicContact CD1-CD2 3.54Å; L230-W382 HydrophobicContact CD1-CE3 3.84Å; L230-W382 HydrophobicContact CD1-CG 3.88Å; L230-W382 HydrophobicContact CD1-CH2 4.43Å; L230-W382 HydrophobicContact CD1-CZ2 4.2Å; L230-W382 HydrophobicContact CD1-CZ3 4.27Å; R259-W382 HydrophobicContact CB-CH2 4.18Å; R259-W382 HydrophobicContact CB-CZ3 4.4Å; Y260-W382 WeakPolarHBondContact O-CH2 3.3Å; V261-W382 HydrophobicContact CG1-CH2 4.22Å; V261-W382 HydrophobicContact CG1-CZ3 4.49Å; I378-W382 HydrophobicContact CD1-CE3 4.14Å; I378-W382 HydrophobicContact CD1-CZ3 3.94Å; I378-W382 HydrophobicContact CG2-CB 3.88Å; I378-W382 HydrophobicContact CG2-CD2 4.01Å; I378-W382 HydrophobicContact CG2-CE3 3.75Å; I378-W382 HydrophobicContact CG2-CG 4.1Å; P379-W382 HydrophobicContact CB-CG 4.43Å; P379-W382 HydrophobicContact CG-CG 4.47Å; P379-W382 WeakPolarHBondContact O-CB 3.19Å; P379-W382 PolarHBondContact O-N 3.31Å; P379-W382 VanDerWaalsContact O-N 3.13Å; S380-W382 VanDerWaalsContact C-N 3.28Å; S380-W382 PolarHBondContact O-N 3.13Å; W382-I386 HydrophobicContact CE3-CG2 3.78Å; W382-I386 HydrophobicContact CZ3-CG2 4.03Å; W382-R392 PolarHBondContact O-NH1 3.44Å
383	P	95.2	Very high	93.5	Very high	57 Å²	57	47.6 Å²	47.6	37%	0.37	26%	0.261	S	S	.	.			trans	-49	139.5	171.3	-27.5	34.1	0	0	0	112.8	L230 D385 I386 R392	L230-P383 HydrophobicContact CD2-CG 4.05Å; P383-D385 VanDerWaalsContact C-N 3.25Å; P383-D385 WeakPolarHBondContact CB-OD1 3.3Å; P383-D385 PolarHBondContact O-N 3.16Å; P383-I386 HydrophobicContact CB-CD1 4.13Å; P383-I386 HydrophobicContact CB-CG1 4.23Å; P383-I386 HydrophobicContact CG-CD1 4.02Å; P383-I386 PolarHBondContact O-N 3.05Å; P383-R392 PolarHBondContact O-NH2 3.2Å
384	A	94.2	Very high	93.2	Very high	76 Å²	76	52.3 Å²	52.3	63%	0.628	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-28.6	-170.9	0	0	0	0	0	113.8	I386 R392	A384-I386 VanDerWaalsContact C-N 3.29Å; A384-I386 PolarHBondContact O-N 3.38Å; A384-R392 PolarHBondContact O-NH2 3.23Å
385	D	92.6	Very high	92.6	Very high	123 Å²	123	53.2 Å²	53.2	66%	0.658	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-15.9	179.3	60.7	-54.7	0	0	0	113.6	P383 A387 P388	P383-D385 VanDerWaalsContact C-N 3.25Å; P383-D385 WeakPolarHBondContact CB-OD1 3.3Å; P383-D385 PolarHBondContact O-N 3.16Å; D385-A387 PolarHBondContact O-N 2.98Å; D385-P388 WeakPolarHBondContact O-CD 3.26Å
386	I	92.7	Very high	91.2	Very high	21 Å²	21	53.8 Å²	53.8	11%	0.108	30%	0.299	C	S	.	.	S	Bend	trans	-83.7	116.8	176.9	-58.9	-179.9	0	0	0	109.5	L230 L344 W382 P383 A384 R392	L230-I386 HydrophobicContact CD1-CD1 3.94Å; L230-I386 HydrophobicContact CD2-CD1 3.45Å; L230-I386 VanDerWaalsContact CD2-CD1 3.45Å; L230-I386 HydrophobicContact CG-CD1 4.28Å; L344-I386 HydrophobicContact CD1-CG2 4.42Å; W382-I386 HydrophobicContact CE3-CG2 3.78Å; W382-I386 HydrophobicContact CZ3-CG2 4.03Å; P383-I386 HydrophobicContact CB-CD1 4.13Å; P383-I386 HydrophobicContact CB-CG1 4.23Å; P383-I386 HydrophobicContact CG-CD1 4.02Å; P383-I386 PolarHBondContact O-N 3.05Å; A384-I386 VanDerWaalsContact C-N 3.29Å; A384-I386 PolarHBondContact O-N 3.38Å; I386-R392 PolarHBondContact O-NH2 2.84Å
387	A	92.1	Very high	90.9	Very high	9 Å²	9	55.8 Å²	55.8	7%	0.074	31%	0.309	C	S	.	.	S	Bend	trans	47.9	56.9	-179.7	0	0	0	0	0	113.3	L344 I378 D385 T389 I390	L344-A387 HydrophobicContact CB-CB 4.44Å; L344-A387 HydrophobicContact CD1-CB 4.36Å; L344-A387 HydrophobicContact CD2-CB 4.14Å; I378-A387 HydrophobicContact CD1-CB 4.01Å; I378-A387 HydrophobicContact CG1-CB 4.08Å; D385-A387 PolarHBondContact O-N 2.98Å; A387-T389 PolarHBondContact O-N 2.96Å; A387-I390 HydrophobicContact CB-CB 4.34Å; A387-I390 HydrophobicContact CB-CD1 3.89Å; A387-I390 HydrophobicContact CB-CG1 4.1Å; A387-I390 PolarHBondContact O-N 3.18Å; A387-I390 VanDerWaalsContact O-N 3.07Å
388	P	91.3	Very high	90.7	Very high	95 Å²	95	58.2 Å²	58.2	62%	0.617	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.1	-168.8	26.8	-35.9	0	0	0	113.9	D385	D385-P388 WeakPolarHBondContact O-CD 3.26Å
389	T	92.1	Very high	90.4	Very high	76 Å²	76	61.4 Å²	61.4	47%	0.466	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-18.6	-178.8	35.7	0	0	0	0	113.8	S348 A387	S348-T389 WeakPolarHBondContact CB-OG1 3.23Å; S348-T389 PolarHBondContact OG-OG1 3.01Å; A387-T389 PolarHBondContact O-N 2.96Å
390	I	93.3	Very high	90.1	Very high	10 Å²	10	65.1 Å²	65.1	5%	0.051	36%	0.362	C	S	.	.	S	Bend	trans	-81.1	136.2	176.1	-58.6	-176.8	0	0	0	108.6	L344 A347 S348 P376 I378 A387 R392	L344-I390 HydrophobicContact CD2-CD1 4.39Å; A347-I390 HydrophobicContact CB-CD1 4.02Å; S348-I390 WeakPolarHBondContact OG-CG1 3.43Å; P376-I390 HydrophobicContact CB-CG2 4.47Å; P376-I390 HydrophobicContact CG-CG2 4.46Å; I378-I390 HydrophobicContact CD1-CB 4.46Å; I378-I390 HydrophobicContact CD1-CD1 4.48Å; I378-I390 HydrophobicContact CD1-CG2 4.31Å; I378-I390 HydrophobicContact CG1-CB 3.78Å; I378-I390 HydrophobicContact CG1-CG2 3.77Å; A387-I390 HydrophobicContact CB-CB 4.34Å; A387-I390 HydrophobicContact CB-CD1 3.89Å; A387-I390 HydrophobicContact CB-CG1 4.1Å; A387-I390 PolarHBondContact O-N 3.18Å; A387-I390 VanDerWaalsContact O-N 3.07Å; I390-R392 PolarHBondContact O-N 3.38Å
391	K	93.2	Very high	89.9	Confident	160 Å²	160	66 Å²	66	70%	0.696	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-55.5	133.6	-179.1	-178.3	174.7	179.2	174.9	0	111.3	Y377 I378	Y377-K391 CarbonylContact C-O 3.49Å; Y377-K391 VanDerWaalsContact CA-O 3.28Å; Y377-K391 WeakPolarHBondContact CA-O 3.33Å; Y377-K391 WeakPolarHBondContact CB-O 3.38Å; I378-K391 PolarHBondContact N-O 2.65Å
392	R	93.5	Very high	89.6	Confident	76 Å²	76	66.8 Å²	66.8	29%	0.287	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	144.8	174.4	-74.4	174.7	178.4	-95.9	-2.1	112.3	I378 P379 W382 P383 A384 I386 I390	I378-R392 HydrophobicContact CB-CG 3.93Å; I378-R392 HydrophobicContact CG2-CG 4.23Å; I378-R392 CarbonylContact O-C 3.48Å; I378-R392 WeakPolarHBondContact O-CA 3.22Å; P379-R392 PolarHBondContact O-NH1 2.93Å; W382-R392 PolarHBondContact O-NH1 3.44Å; P383-R392 PolarHBondContact O-NH2 3.2Å; A384-R392 PolarHBondContact O-NH2 3.23Å; I386-R392 PolarHBondContact O-NH2 2.84Å; I390-R392 PolarHBondContact O-N 3.38Å
393	I	88.9	Confident	89.1	Confident	50 Å²	50	71.1 Å²	71.1	26%	0.256	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	133.2	171.5	-61.9	-172.3	0	0	0	108.4	Y377 I378 S380 C395	Y377-I393 HydrophobicContact CD1-CD1 3.97Å; Y377-I393 HydrophobicContact CD2-CB 3.9Å; Y377-I393 HydrophobicContact CD2-CD1 3.4Å; Y377-I393 VanDerWaalsContact CD2-CD1 3.4Å; Y377-I393 HydrophobicContact CD2-CG1 3.67Å; Y377-I393 HydrophobicContact CE1-CD1 4.32Å; Y377-I393 HydrophobicContact CE2-CB 4.33Å; Y377-I393 HydrophobicContact CE2-CD1 3.78Å; Y377-I393 HydrophobicContact CE2-CG1 4.35Å; Y377-I393 HydrophobicContact CG-CD1 3.48Å; Y377-I393 VanDerWaalsContact CG-CD1 3.48Å; Y377-I393 HydrophobicContact CG-CG1 3.94Å; I378-I393 PolarHBondContact O-N 3.25Å; S380-I393 WeakPolarHBondContact CB-O 3.26Å; S380-I393 PolarHBondContact N-O 3.09Å; S380-I393 PolarHBondContact OG-O 3.22Å; I393-C395 PolarHBondContact O-N 2.87Å; I393-C395 VanDerWaalsContact O-N 3.17Å
394	I	84.3	Confident	88.6	Confident	138 Å²	138	72.2 Å²	72.2	71%	0.708	40%	0.401	S	S	*	.			trans	-68	112.7	173	-58.5	172.9	0	0	0	107.4	T396	I394-T396 HydrophobicContact CG2-CG2 4.17Å
395	C	78.6	Confident	88.1	Confident	23 Å²	23	71.9 Å²	71.9	16%	0.155	38%	0.382	C	S	.	.			trans	-85.1	120.8	169.1	-61.2	0	0	0	0	106.7	I168 L207 S380 I393	I168-C395 HydrophobicContact CD1-CB 3.26Å; I168-C395 WeakPolarHBondContact CD1-O 3.04Å; L207-C395 HydrophobicContact CD2-CB 3.87Å; S380-C395 PolarHBondContact OG-N 3.07Å; I393-C395 PolarHBondContact O-N 2.87Å; I393-C395 VanDerWaalsContact O-N 3.17Å
396	T	64.9	Low	87.7	Confident	82 Å²	82	67.3 Å²	67.3	50%	0.503	36%	0.357	S	S	.	.			trans	-99.5	0	-177.6	50.9	0	0	0	0	112.6	N136 I394	N136-T396 VanDerWaalsContact CG-OXT 3.23Å; N136-T396 PolarHBondContact ND2-O 2.87Å; N136-T396 PolarHBondContact ND2-OXT 3.36Å; I394-T396 HydrophobicContact CG2-CG2 4.17Å

Retrieved 396 of 396 residues in 357.9 ms (Link to these results)

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