A0A023PX70_HUMAN Loading...

Tyrosine-protein kinase

AlphaFold DB , UniProt , Accession A0A023PX70, Species HUMAN (Homo sapiens, Human), Gene n/a, Length 340 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	L	96.7	Very high	88.1	Confident	99 Å²	99	89.5 Å²	89.5	52%	0.518	50%	0.5	S	S	.	.				0	159.6	0	63.3	82.1	0	0	0	109.7	R3 S15 A68	L1-R3 HydrophobicContact CD1-CB 3.99Å; L1-R3 HydrophobicContact CD1-CG 4.15Å; L1-S15 PolarHBondContact N-O 2.83Å; L1-S15 PolarHBondContact O-N 3.03Å; L1-A68 HydrophobicContact CB-CB 4.09Å; L1-A68 HydrophobicContact CD2-CB 4Å
2	V	97.1	Very high	88.7	Confident	57 Å²	57	89 Å²	89	35%	0.345	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	135.8	168.7	-176.5	0	0	0	0	108.3	R12 S13 I14 I27 L46 V50	V2-R12 HydrophobicContact CG1-CB 4.5Å; V2-S13 WeakPolarHBondContact CA-O 3.37Å; V2-I14 HydrophobicContact CG2-CG1 4.28Å; V2-I27 HydrophobicContact CG1-CD1 3.98Å; V2-L46 HydrophobicContact CG1-CD1 4.25Å; V2-L46 HydrophobicContact CG1-CD2 4.06Å; V2-V50 HydrophobicContact CG2-CG2 3.94Å
3	R	95.5	Very high	89.4	Confident	106 Å²	106	84 Å²	84	40%	0.4	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	149.1	177.7	59	-179.9	179.1	83.2	-2.7	110.8	L1 R12 S13 S15 H24	L1-R3 HydrophobicContact CD1-CB 3.99Å; L1-R3 HydrophobicContact CD1-CG 4.15Å; R3-R12 CarbonylContact O-C 3.58Å; R3-R12 WeakPolarHBondContact O-CA 3.24Å; R3-S13 PolarHBondContact N-O 2.93Å; R3-S13 PolarHBondContact O-N 2.92Å; R3-S15 PolarHBondContact NE-OG 2.92Å; R3-S15 VanDerWaalsContact NE-OG 3.12Å; R3-H24 PolarHBondContact NH2-ND1 3.29Å
4	E	93.3	Very high	90	Very high	98 Å²	98	78.1 Å²	78.1	46%	0.458	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	151.1	172.1	-174.1	158.9	-144.5	0	0	109.5	G10 Q11 R12	E4-G10 VanDerWaalsContact OE1-CA 3.29Å; E4-G10 WeakPolarHBondContact OE1-CA 3.22Å; E4-G10 PolarHBondContact OE1-N 2.66Å; E4-Q11 CarbonylContact C-O 3.56Å; E4-Q11 WeakPolarHBondContact CA-O 3.07Å; E4-R12 HydrophobicContact CB-CG 4.33Å; E4-R12 HydrophobicContact CG-CG 4.38Å; E4-R12 IonicContact OE1-CZ 3.01Å; E4-R12 IonicContact OE1-NE 3.72Å; E4-R12 IonicContact OE1-NH2 3.83Å; E4-R12 PolarHBondContact OE1-NH2 3.37Å
5	S	83.9	Confident	90.5	Very high	36 Å²	36	73.8 Å²	73.8	25%	0.252	41%	0.406	S	S	.	.			trans	-80.7	123.2	175.3	-163.5	0	0	0	0	110	S7 S8 Q11	S5-S7 PolarHBondContact OG-OG 2.91Å; S5-S8 CarbonylContact O-C 3.41Å; S5-S8 PolarHBondContact O-N 3.1Å; S5-Q11 PolarHBondContact N-O 2.76Å
6	E	78.8	Confident	91	Very high	194 Å²	194	70.3 Å²	70.3	91%	0.907	39%	0.386	S	S	*	.	S	Bend	trans	-69	-35.9	175.4	-64.3	-175.4	-175.9	0	0	111.7	S8	E6-S8 VanDerWaalsContact C-N 3.31Å; E6-S8 PolarHBondContact O-N 3.24Å
7	S	79.4	Confident	91.4	Very high	105 Å²	105	77.6 Å²	77.6	73%	0.734	41%	0.407	S	S	*	.	S	Bend	trans	-77	-12.6	177.6	58.3	0	0	0	0	114.4	S5	S5-S7 PolarHBondContact OG-OG 2.91Å
8	S	83.4	Confident	91.7	Very high	57 Å²	57	78.6 Å²	78.6	40%	0.399	41%	0.405	S	S	.	.	S	Bend	trans	-147.6	78.3	-177.3	-64.1	0	0	0	0	109.8	S5 E6 G10 Q11	S5-S8 CarbonylContact O-C 3.41Å; S5-S8 PolarHBondContact O-N 3.1Å; E6-S8 VanDerWaalsContact C-N 3.31Å; E6-S8 PolarHBondContact O-N 3.24Å; S8-G10 PolarHBondContact O-N 3.34Å; S8-Q11 WeakPolarHBondContact O-CB 3.24Å; S8-Q11 PolarHBondContact O-N 3.39Å
9	P	84.9	Confident	91.9	Very high	115 Å²	115	82.5 Å²	82.5	75%	0.747	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	138.2	-177.9	-28.2	35.7	0	0	0	112.3	Q11	P9-Q11 VanDerWaalsContact C-N 3.32Å; P9-Q11 PolarHBondContact O-N 2.56Å
10	G	85	Confident	91.9	Very high	34 Å²	34	81.5 Å²	81.5	35%	0.351	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	89	-21.6	-174.8	0	0	0	0	0	115	E4 S8	E4-G10 VanDerWaalsContact OE1-CA 3.29Å; E4-G10 WeakPolarHBondContact OE1-CA 3.22Å; E4-G10 PolarHBondContact OE1-N 2.66Å; S8-G10 PolarHBondContact O-N 3.34Å
11	Q	90.8	Very high	92.1	Very high	84 Å²	84	85.9 Å²	85.9	39%	0.393	44%	0.443	S	S	.	.			trans	-78.5	125.7	173.1	-67.2	-66.3	-45.3	0	0	110.6	E4 S5 S8 P9	E4-Q11 CarbonylContact C-O 3.56Å; E4-Q11 WeakPolarHBondContact CA-O 3.07Å; S5-Q11 PolarHBondContact N-O 2.76Å; S8-Q11 WeakPolarHBondContact O-CB 3.24Å; S8-Q11 PolarHBondContact O-N 3.39Å; P9-Q11 VanDerWaalsContact C-N 3.32Å; P9-Q11 PolarHBondContact O-N 2.56Å
12	R	95.8	Very high	92.1	Very high	83 Å²	83	85.2 Å²	85.2	31%	0.313	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	156.7	-178.1	-60.8	-173.8	-178.9	92	10.7	112.3	V2 R3 E4 I27	V2-R12 HydrophobicContact CG1-CB 4.5Å; R3-R12 CarbonylContact O-C 3.58Å; R3-R12 WeakPolarHBondContact O-CA 3.24Å; E4-R12 HydrophobicContact CB-CG 4.33Å; E4-R12 HydrophobicContact CG-CG 4.38Å; E4-R12 IonicContact OE1-CZ 3.01Å; E4-R12 IonicContact OE1-NE 3.72Å; E4-R12 IonicContact OE1-NH2 3.83Å; E4-R12 PolarHBondContact OE1-NH2 3.37Å; R12-I27 HydrophobicContact CB-CB 4.3Å; R12-I27 HydrophobicContact CB-CD1 3.88Å; R12-I27 PolarHBondContact O-N 3.15Å
13	S	96.9	Very high	92.1	Very high	24 Å²	24	86 Å²	86	17%	0.168	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	146.7	176.6	-62.8	0	0	0	0	112.1	V2 R3 Y25	V2-S13 WeakPolarHBondContact CA-O 3.37Å; R3-S13 PolarHBondContact N-O 2.93Å; R3-S13 PolarHBondContact O-N 2.92Å; S13-Y25 CarbonylContact C-O 3.52Å; S13-Y25 WeakPolarHBondContact CA-O 3.37Å; S13-Y25 WeakPolarHBondContact CB-O 3.4Å
14	I	97.9	Very high	92.2	Very high	1 Å²	1	86.5 Å²	86.5	1%	0.005	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	134.7	167.1	-66.5	166.8	0	0	0	108.1	V2 L16 H24 Y25 I27 V37 L49 L64	V2-I14 HydrophobicContact CG2-CG1 4.28Å; I14-L16 HydrophobicContact CG2-CB 4.35Å; I14-H24 WeakPolarHBondContact O-CA 3.28Å; I14-Y25 HydrophobicContact CB-CD2 4.47Å; I14-Y25 HydrophobicContact CG2-CD2 4.35Å; I14-Y25 PolarHBondContact N-O 3.06Å; I14-Y25 PolarHBondContact O-N 3.13Å; I14-I27 HydrophobicContact CD1-CD1 4.49Å; I14-I27 HydrophobicContact CD1-CG1 4.38Å; I14-I27 HydrophobicContact CG1-CD1 4.04Å; I14-I27 HydrophobicContact CG1-CG1 4.18Å; I14-V37 HydrophobicContact CD1-CG2 3.95Å; I14-L49 HydrophobicContact CD1-CD2 3.83Å; I14-L64 HydrophobicContact CD1-CD1 4.34Å; I14-L64 HydrophobicContact CG2-CD2 4.04Å
15	S	97.9	Very high	92.3	Very high	14 Å²	14	83.7 Å²	83.7	10%	0.098	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121.1	167.4	-54.2	0	0	0	0	109	L1 R3 Y23 H24	L1-S15 PolarHBondContact N-O 2.83Å; L1-S15 PolarHBondContact O-N 3.03Å; R3-S15 PolarHBondContact NE-OG 2.92Å; R3-S15 VanDerWaalsContact NE-OG 3.12Å; S15-Y23 WeakPolarHBondContact CA-O 3.4Å; S15-H24 PolarHBondContact OG-CE1 3.25Å; S15-H24 PolarHBondContact OG-ND1 2.98Å
16	L	98.2	Very high	92.9	Very high	18 Å²	18	89.4 Å²	89.4	9%	0.094	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	131.6	-168.5	177.2	58.3	0	0	0	110.6	I14 V22 Y23 Y25 L60 I61 T62 L64	I14-L16 HydrophobicContact CG2-CB 4.35Å; L16-V22 CarbonylContact O-C 3.59Å; L16-V22 WeakPolarHBondContact O-CA 3.26Å; L16-Y23 PolarHBondContact N-O 3.03Å; L16-Y23 PolarHBondContact O-N 3.38Å; L16-Y25 HydrophobicContact CB-CE2 4.27Å; L16-Y25 HydrophobicContact CD2-CE2 4.41Å; L16-L60 HydrophobicContact CD2-CB 4.35Å; L16-L60 HydrophobicContact CD2-CD1 4.42Å; L16-I61 HydrophobicContact CD2-CG2 3.94Å; L16-I61 HydrophobicContact CG-CG2 4.44Å; L16-T62 HydrophobicContact CD1-CG2 4.15Å; L16-T62 HydrophobicContact CD2-CG2 3.81Å; L16-T62 WeakPolarHBondContact CD2-O 3.37Å; L16-T62 HydrophobicContact CG-CG2 4.1Å; L16-L64 HydrophobicContact CD1-CD2 3.87Å; L16-L64 HydrophobicContact CD2-CD2 4.03Å; L16-L64 HydrophobicContact CG-CD2 4.39Å
17	R	97.9	Very high	93.8	Very high	195 Å²	195	80.4 Å²	80.4	74%	0.736	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	133.1	177	179.9	179.4	173.2	170.9	-1.4	110.3	R21	R17-R21 CarbonylContact C-O 3.46Å; R17-R21 VanDerWaalsContact CA-O 3.28Å; R17-R21 WeakPolarHBondContact CA-O 3.41Å
18	Y	97.6	Very high	94.6	Very high	95 Å²	95	76.9 Å²	76.9	37%	0.373	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	132.2	172.4	-174.7	-111.9	0	0	0	109.6	G20 R21 I61 T62	Y18-G20 VanDerWaalsContact C-N 3.31Å; Y18-G20 PolarHBondContact O-N 2.96Å; Y18-R21 PolarHBondContact N-O 2.94Å; Y18-R21 PolarHBondContact O-N 3.44Å; Y18-I61 HydrophobicContact CD1-CG1 3.7Å; Y18-I61 HydrophobicContact CE1-CG1 4.25Å; Y18-I61 HydrophobicContact CG-CG1 4.36Å; Y18-I61 HydrophobicContact CG-CG2 4.42Å; Y18-T62 HydrophobicContact CD2-CG2 3.68Å; Y18-T62 HydrophobicContact CE2-CG2 4.46Å; Y18-T62 HydrophobicContact CG-CG2 4.05Å
19	E	95.8	Very high	95.3	Very high	152 Å²	152	78 Å²	78	71%	0.71	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	48.7	179.9	-64.5	-58.5	143.8	0	0	113.9	R21	E19-R21 PolarHBondContact O-N 2.81Å; E19-R21 VanDerWaalsContact O-N 3.11Å
20	G	91.5	Very high	95.8	Very high	63 Å²	63	73.2 Å²	73.2	65%	0.649	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	-4.7	178.5	0	0	0	0	0	115.8	Y18	Y18-G20 VanDerWaalsContact C-N 3.31Å; Y18-G20 PolarHBondContact O-N 2.96Å
21	R	95.4	Very high	96.3	Very high	173 Å²	173	78 Å²	78	65%	0.653	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.7	156	178.6	-59.3	-179.6	72.6	95	-0.9	111.6	R17 Y18 E19 Y23	R17-R21 CarbonylContact C-O 3.46Å; R17-R21 VanDerWaalsContact CA-O 3.28Å; R17-R21 WeakPolarHBondContact CA-O 3.41Å; Y18-R21 PolarHBondContact N-O 2.94Å; Y18-R21 PolarHBondContact O-N 3.44Å; E19-R21 PolarHBondContact O-N 2.81Å; E19-R21 VanDerWaalsContact O-N 3.11Å; R21-Y23 HydrophobicContact CB-CE2 3.87Å
22	V	97.2	Very high	96.5	Very high	86 Å²	86	78.4 Å²	78.4	52%	0.521	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129.4	173	-177.4	0	0	0	0	109.5	L16	L16-V22 CarbonylContact O-C 3.59Å; L16-V22 WeakPolarHBondContact O-CA 3.26Å
23	Y	97.4	Very high	96.6	Very high	74 Å²	74	76.5 Å²	76.5	29%	0.29	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139.3	178.2	-63	-98.5	0	0	0	109.5	S15 L16 R21 I61	S15-Y23 WeakPolarHBondContact CA-O 3.4Å; L16-Y23 PolarHBondContact N-O 3.03Å; L16-Y23 PolarHBondContact O-N 3.38Å; R21-Y23 HydrophobicContact CB-CE2 3.87Å; Y23-I61 HydrophobicContact CD2-CG2 3.78Å; Y23-I61 HydrophobicContact CE1-CG1 4.34Å; Y23-I61 HydrophobicContact CE2-CG1 4.26Å; Y23-I61 HydrophobicContact CE2-CG2 4.16Å; Y23-I61 HydrophobicContact CG-CB 4.5Å; Y23-I61 HydrophobicContact CG-CG2 3.98Å
24	H	96.5	Very high	96.6	Very high	115 Å²	115	78.7 Å²	78.7	53%	0.532	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.4	-178.7	-59.2	-72.7	0	0	0	110.4	R3 I14 S15	R3-H24 PolarHBondContact NH2-ND1 3.29Å; I14-H24 WeakPolarHBondContact O-CA 3.28Å; S15-H24 PolarHBondContact OG-CE1 3.25Å; S15-H24 PolarHBondContact OG-ND1 2.98Å
25	Y	96.8	Very high	96.6	Very high	40 Å²	40	79.6 Å²	79.6	16%	0.157	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.1	-179.9	-54.4	-95	0	0	0	109.1	S13 I14 L16 V37 L60 I61	S13-Y25 CarbonylContact C-O 3.52Å; S13-Y25 WeakPolarHBondContact CA-O 3.37Å; S13-Y25 WeakPolarHBondContact CB-O 3.4Å; I14-Y25 HydrophobicContact CB-CD2 4.47Å; I14-Y25 HydrophobicContact CG2-CD2 4.35Å; I14-Y25 PolarHBondContact N-O 3.06Å; I14-Y25 PolarHBondContact O-N 3.13Å; L16-Y25 HydrophobicContact CB-CE2 4.27Å; L16-Y25 HydrophobicContact CD2-CE2 4.41Å; Y25-V37 HydrophobicContact CD1-CG1 4.15Å; Y25-V37 HydrophobicContact CG-CG1 4.47Å; Y25-L60 HydrophobicContact CD1-CD2 3.46Å; Y25-L60 VanDerWaalsContact CD1-CD2 3.46Å; Y25-L60 HydrophobicContact CD2-CD2 3.67Å; Y25-L60 HydrophobicContact CE1-CD2 3.68Å; Y25-L60 HydrophobicContact CE2-CD2 3.88Å; Y25-L60 HydrophobicContact CG-CD2 3.46Å; Y25-L60 VanDerWaalsContact CG-CD2 3.46Å; Y25-I61 VanDerWaalsContact OH-CB 3.25Å; Y25-I61 WeakPolarHBondContact OH-CB 3.29Å; Y25-I61 VanDerWaalsContact OH-CG2 3.3Å; Y25-I61 WeakPolarHBondContact OH-CG2 3.29Å; Y25-I61 PolarHBondContact OH-N 2.8Å
26	R	96.1	Very high	96.6	Very high	156 Å²	156	81.3 Å²	81.3	59%	0.589	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	132.2	172.6	-172.3	174.9	69.3	164.3	0.1	109.3	N28	R26-N28 VanDerWaalsContact CZ-OD1 3.26Å; R26-N28 PolarHBondContact NE-OD1 2.97Å; R26-N28 PolarHBondContact NH2-OD1 2.85Å
27	I	97.6	Very high	96.6	Very high	5 Å²	5	81.7 Å²	81.7	3%	0.026	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	114.6	168.5	-61.3	168.7	0	0	0	106.5	V2 R12 I14 L35 L46 L49	V2-I27 HydrophobicContact CG1-CD1 3.98Å; R12-I27 HydrophobicContact CB-CB 4.3Å; R12-I27 HydrophobicContact CB-CD1 3.88Å; R12-I27 PolarHBondContact O-N 3.15Å; I14-I27 HydrophobicContact CD1-CD1 4.49Å; I14-I27 HydrophobicContact CD1-CG1 4.38Å; I14-I27 HydrophobicContact CG1-CD1 4.04Å; I14-I27 HydrophobicContact CG1-CG1 4.18Å; I27-L35 HydrophobicContact CG2-CB 3.99Å; I27-L35 HydrophobicContact CG2-CD2 4.31Å; I27-L46 HydrophobicContact CD1-CD1 3.62Å; I27-L49 HydrophobicContact CG2-CD1 4.09Å
28	N	96.3	Very high	96.5	Very high	31 Å²	31	73.5 Å²	73.5	17%	0.166	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	152.7	178.3	-54.3	-70.1	0	0	0	109.9	R26 L35 Y36	R26-N28 VanDerWaalsContact CZ-OD1 3.26Å; R26-N28 PolarHBondContact NE-OD1 2.97Å; R26-N28 PolarHBondContact NH2-OD1 2.85Å; N28-L35 WeakPolarHBondContact O-CA 3.36Å; N28-Y36 HydrophobicContact CB-CD1 4.04Å; N28-Y36 HydrophobicContact CB-CD2 4.17Å; N28-Y36 HydrophobicContact CB-CE1 3.56Å; N28-Y36 HydrophobicContact CB-CE2 3.71Å; N28-Y36 HydrophobicContact CB-CG 4.33Å; N28-Y36 PolarHBondContact N-O 3.04Å; N28-Y36 PolarHBondContact O-N 2.9Å
29	T	96.6	Very high	96.3	Very high	79 Å²	79	72.2 Å²	72.2	49%	0.485	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124	174.7	-51	0	0	0	0	108.5	K34 L35	T29-K34 CarbonylContact C-O 3.58Å; T29-K34 WeakPolarHBondContact CA-O 3.28Å; T29-L35 HydrophobicContact CG2-CD2 4.3Å
30	A	96.1	Very high	96.3	Very high	15 Å²	15	73.1 Å²	73.1	12%	0.124	39%	0.394	C	S	.	.			trans	-76.6	169.8	175.8	0	0	0	0	0	111.5	D32 G33 K34 Y36	A30-D32 WeakPolarHBondContact CB-OD1 3.26Å; A30-D32 PolarHBondContact O-N 2.98Å; A30-G33 PolarHBondContact O-N 3.4Å; A30-K34 HydrophobicContact CB-CB 4.49Å; A30-K34 PolarHBondContact N-O 3.17Å; A30-Y36 HydrophobicContact CB-CD1 4.39Å; A30-Y36 HydrophobicContact CB-CE1 4.04Å
31	S	96	Very high	96.6	Very high	136 Å²	136	71.2 Å²	71.2	95%	0.951	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-25.8	179.5	54.4	0	0	0	0	113.7	G33	S31-G33 VanDerWaalsContact C-N 3.29Å
32	D	95.9	Very high	96.8	Very high	92 Å²	92	68.8 Å²	68.8	49%	0.492	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	8.3	174.8	66.9	-16.1	0	0	0	113.1	A30 K34	A30-D32 WeakPolarHBondContact CB-OD1 3.26Å; A30-D32 PolarHBondContact O-N 2.98Å; D32-K34 VanDerWaalsContact C-N 3.3Å; D32-K34 PolarHBondContact O-N 3.38Å; D32-K34 PolarHBondContact OD1-N 2.93Å; D32-K34 VanDerWaalsContact OD2-CD 3.26Å; D32-K34 WeakPolarHBondContact OD2-CD 3.25Å; D32-K34 VanDerWaalsContact OD2-CE 3.24Å; D32-K34 WeakPolarHBondContact OD2-CE 3.47Å; D32-K34 IonicContact OD2-NZ 3.76Å
33	G	95.9	Very high	96.8	Very high	43 Å²	43	66.5 Å²	66.5	44%	0.443	35%	0.345	S	S	.	.	S	Bend	trans	83.2	-3.7	178.6	0	0	0	0	0	115	A30 S31	A30-G33 PolarHBondContact O-N 3.4Å; S31-G33 VanDerWaalsContact C-N 3.29Å
34	K	97.8	Very high	96.9	Very high	70 Å²	70	68.3 Å²	68.3	30%	0.304	36%	0.359	S	S	.	.			trans	-69	144.4	179.5	-66.9	-177.2	-174.3	176	0	112.4	T29 A30 D32 R42 F43 N44	T29-K34 CarbonylContact C-O 3.58Å; T29-K34 WeakPolarHBondContact CA-O 3.28Å; A30-K34 HydrophobicContact CB-CB 4.49Å; A30-K34 PolarHBondContact N-O 3.17Å; D32-K34 VanDerWaalsContact C-N 3.3Å; D32-K34 PolarHBondContact O-N 3.38Å; D32-K34 PolarHBondContact OD1-N 2.93Å; D32-K34 VanDerWaalsContact OD2-CD 3.26Å; D32-K34 WeakPolarHBondContact OD2-CD 3.25Å; D32-K34 VanDerWaalsContact OD2-CE 3.24Å; D32-K34 WeakPolarHBondContact OD2-CE 3.47Å; D32-K34 IonicContact OD2-NZ 3.76Å; K34-R42 HydrophobicContact CB-CB 3.96Å; K34-R42 HydrophobicContact CD-CB 4.04Å; K34-F43 CarbonylContact C-O 3.59Å; K34-F43 VanDerWaalsContact CA-O 3.28Å; K34-F43 WeakPolarHBondContact CA-O 3.36Å; K34-F43 WeakPolarHBondContact CB-O 3.45Å; K34-N44 WeakPolarHBondContact CE-OD1 3.3Å
35	L	98.1	Very high	96.9	Very high	20 Å²	20	65.7 Å²	65.7	11%	0.105	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	141.5	-179.6	-54.5	178.5	0	0	0	110.6	I27 N28 T29 F43 L46 L49	I27-L35 HydrophobicContact CG2-CB 3.99Å; I27-L35 HydrophobicContact CG2-CD2 4.31Å; N28-L35 WeakPolarHBondContact O-CA 3.36Å; T29-L35 HydrophobicContact CG2-CD2 4.3Å; L35-F43 PolarHBondContact N-O 3.44Å; L35-F43 PolarHBondContact O-N 2.82Å; L35-L46 HydrophobicContact CD1-CB 3.98Å; L35-L46 HydrophobicContact CD1-CD1 4.43Å; L35-L49 HydrophobicContact CB-CD1 3.83Å
36	Y	98.1	Very high	97	Very high	50 Å²	50	66.3 Å²	66.3	20%	0.196	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	156.7	177.3	67.8	-82.3	0	0	0	113.7	N28 A30 S41 R42	N28-Y36 HydrophobicContact CB-CD1 4.04Å; N28-Y36 HydrophobicContact CB-CD2 4.17Å; N28-Y36 HydrophobicContact CB-CE1 3.56Å; N28-Y36 HydrophobicContact CB-CE2 3.71Å; N28-Y36 HydrophobicContact CB-CG 4.33Å; N28-Y36 PolarHBondContact N-O 3.04Å; N28-Y36 PolarHBondContact O-N 2.9Å; A30-Y36 HydrophobicContact CB-CD1 4.39Å; A30-Y36 HydrophobicContact CB-CE1 4.04Å; Y36-S41 VanDerWaalsContact CB-O 3.24Å; Y36-S41 WeakPolarHBondContact CB-O 3.36Å; Y36-R42 HydrophobicContact CD1-CG 4.3Å; Y36-R42 HydrophobicContact CG-CG 4.23Å
37	V	97.3	Very high	97.1	Very high	25 Å²	25	62.4 Å²	62.4	15%	0.152	36%	0.358	C	S	.	.	S	Bend	trans	-103	-54.2	162	179.1	0	0	0	0	109.2	I14 Y25 L60	I14-V37 HydrophobicContact CD1-CG2 3.95Å; Y25-V37 HydrophobicContact CD1-CG1 4.15Å; Y25-V37 HydrophobicContact CG-CG1 4.47Å; V37-L60 HydrophobicContact CB-CD2 4.45Å; V37-L60 HydrophobicContact CG1-CD2 3.84Å; V37-L60 HydrophobicContact CG2-CD2 4.41Å
38	S	95.7	Very high	97.1	Very high	23 Å²	23	66 Å²	66	16%	0.161	38%	0.375	C	S	.	.	S	Bend	trans	-90.9	130.3	172.9	-63.2	0	0	0	0	110.2	E40 S41 D58	S38-E40 PolarHBondContact O-N 2.76Å; S38-E40 VanDerWaalsContact O-N 3.1Å; S38-S41 PolarHBondContact O-N 3.09Å; S38-D58 PolarHBondContact OG-O 2.92Å
39	S	95.1	Very high	97.2	Very high	68 Å²	68	64.6 Å²	64.6	48%	0.476	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.5	-172.7	50.1	0	0	0	0	114.7	R42	S39-R42 PolarHBondContact O-NE 3.29Å; S39-R42 PolarHBondContact O-NH2 2.9Å
40	E	96	Very high	97.3	Very high	172 Å²	172	63 Å²	63	80%	0.804	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-24.7	177.7	-54	-71.6	177.4	0	0	112.6	S38	S38-E40 PolarHBondContact O-N 2.76Å; S38-E40 VanDerWaalsContact O-N 3.1Å
41	S	97.3	Very high	97.4	Very high	23 Å²	23	68.5 Å²	68.5	16%	0.161	38%	0.38	C	S	.	.			trans	-121.7	97.8	-171.6	-62.6	0	0	0	0	111	Y36 S38 F43 D58	Y36-S41 VanDerWaalsContact CB-O 3.24Å; Y36-S41 WeakPolarHBondContact CB-O 3.36Å; S38-S41 PolarHBondContact O-N 3.09Å; S41-F43 WeakPolarHBondContact O-CE2 3.32Å; S41-D58 WeakPolarHBondContact CB-OD2 3.3Å; S41-D58 PolarHBondContact OG-OD2 3.11Å
42	R	98.3	Very high	97.5	Very high	122 Å²	122	64 Å²	64	46%	0.46	35%	0.345	S	S	.	.			trans	-118.9	136.9	-174.2	-50.3	-175.4	-170.7	175.4	2.6	111.8	K34 Y36 S39	K34-R42 HydrophobicContact CB-CB 3.96Å; K34-R42 HydrophobicContact CD-CB 4.04Å; Y36-R42 HydrophobicContact CD1-CG 4.3Å; Y36-R42 HydrophobicContact CG-CG 4.23Å; S39-R42 PolarHBondContact O-NE 3.29Å; S39-R42 PolarHBondContact O-NH2 2.9Å
43	F	98.4	Very high	97.7	Very high	37 Å²	37	59.7 Å²	59.7	16%	0.162	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-127.6	150.8	-171.7	-54.5	-80.9	0	0	0	111.6	K34 L35 S41 E48 L49 H52	K34-F43 CarbonylContact C-O 3.59Å; K34-F43 VanDerWaalsContact CA-O 3.28Å; K34-F43 WeakPolarHBondContact CA-O 3.36Å; K34-F43 WeakPolarHBondContact CB-O 3.45Å; L35-F43 PolarHBondContact N-O 3.44Å; L35-F43 PolarHBondContact O-N 2.82Å; S41-F43 WeakPolarHBondContact O-CE2 3.32Å; F43-E48 HydrophobicContact CB-CB 3.82Å; F43-E48 HydrophobicContact CD1-CB 4.05Å; F43-E48 HydrophobicContact CG-CB 4.21Å; F43-L49 HydrophobicContact CB-CB 4.1Å; F43-L49 HydrophobicContact CD2-CB 3.7Å; F43-L49 HydrophobicContact CD2-CD1 4.3Å; F43-L49 HydrophobicContact CD2-CG 3.98Å; F43-L49 HydrophobicContact CG-CB 4.1Å; F43-H52 HydrophobicContact CE1-CB 3.7Å; F43-H52 AromaticContact CE1-CG 3.9Å; F43-H52 HydrophobicContact CE2-CB 4Å; F43-H52 AromaticContact CE2-CD2 3.85Å; F43-H52 AromaticContact CE2-CG 3.97Å; F43-H52 HydrophobicContact CZ-CB 3.37Å; F43-H52 AromaticContact CZ-CD2 3.47Å; F43-H52 VanDerWaalsContact CZ-CD2 3.47Å; F43-H52 WeakPolarHBondContact CZ-CD2 3.27Å; F43-H52 AromaticContact CZ-CG 3.22Å; F43-H52 AromaticContact CZ-ND1 3.66Å; F43-H52 AromaticContact CZ-NE2 3.98Å
44	N	98.2	Very high	97.8	Very high	113 Å²	113	59.3 Å²	59.3	60%	0.604	31%	0.312	S	S	*	.	S	Bend	trans	-76.7	-30.7	-179.2	-61.5	-42	0	0	0	111.1	K34 E48	K34-N44 WeakPolarHBondContact CE-OD1 3.3Å; N44-E48 WeakPolarHBondContact CB-OE2 3.35Å; N44-E48 PolarHBondContact N-OE2 3.1Å
45	T	98.1	Very high	97.8	Very high	60 Å²	60	60.2 Å²	60.2	37%	0.368	32%	0.324	S	S	.	.	S	Bend	trans	-125.5	157.4	-178.4	75.5	0	0	0	0	112.8	A47 E48 L49	T45-A47 PolarHBondContact O-N 2.82Å; T45-E48 PolarHBondContact N-OE2 3.48Å; T45-E48 PolarHBondContact O-N 2.97Å; T45-E48 VanDerWaalsContact OG1-CG 3.28Å; T45-E48 WeakPolarHBondContact OG1-CG 3.38Å; T45-E48 PolarHBondContact OG1-N 3.43Å; T45-L49 PolarHBondContact O-N 3.1Å
46	L	97.7	Very high	97.8	Very high	52 Å²	52	62.7 Å²	62.7	27%	0.272	34%	0.339	S	S	.	.	H	α-helix	trans	-63.2	-34.6	174.7	-177.9	64.2	0	0	0	111.7	V2 I27 L35 L49 V50	V2-L46 HydrophobicContact CG1-CD1 4.25Å; V2-L46 HydrophobicContact CG1-CD2 4.06Å; I27-L46 HydrophobicContact CD1-CD1 3.62Å; L35-L46 HydrophobicContact CD1-CB 3.98Å; L35-L46 HydrophobicContact CD1-CD1 4.43Å; L46-L49 PolarHBondContact O-N 2.6Å; L46-V50 HydrophobicContact CD1-CG2 4.49Å; L46-V50 VanDerWaalsContact O-CG2 3.3Å; L46-V50 WeakPolarHBondContact O-CG2 3.34Å; L46-V50 PolarHBondContact O-N 3.17Å
47	A	98.3	Very high	97.8	Very high	74 Å²	74	61.8 Å²	61.8	61%	0.612	34%	0.342	S	S	*	.	H	α-helix	trans	-66.3	-42.4	179.3	0	0	0	0	0	111.5	T45 V50 H51	T45-A47 PolarHBondContact O-N 2.82Å; A47-V50 PolarHBondContact O-N 2.86Å; A47-H51 VanDerWaalsContact O-CB 3.31Å; A47-H51 WeakPolarHBondContact O-CB 3.14Å; A47-H51 PolarHBondContact O-N 3.49Å
48	E	98.5	Very high	97.8	Very high	82 Å²	82	63.1 Å²	63.1	38%	0.383	35%	0.348	S	S	.	.	H	α-helix	trans	-61.2	-46	174.4	-73.9	165.5	179.9	0	0	111.6	F43 N44 T45 V50 H51 H52	F43-E48 HydrophobicContact CB-CB 3.82Å; F43-E48 HydrophobicContact CD1-CB 4.05Å; F43-E48 HydrophobicContact CG-CB 4.21Å; N44-E48 WeakPolarHBondContact CB-OE2 3.35Å; N44-E48 PolarHBondContact N-OE2 3.1Å; T45-E48 PolarHBondContact N-OE2 3.48Å; T45-E48 PolarHBondContact O-N 2.97Å; T45-E48 VanDerWaalsContact OG1-CG 3.28Å; T45-E48 WeakPolarHBondContact OG1-CG 3.38Å; T45-E48 PolarHBondContact OG1-N 3.43Å; E48-V50 VanDerWaalsContact C-N 3.35Å; E48-V50 PolarHBondContact O-N 2.95Å; E48-H51 PolarHBondContact O-N 2.89Å; E48-H52 PolarHBondContact O-N 3.23Å
49	L	98.4	Very high	97.8	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-58.5	-46.7	176.2	-178	152.8	0	0	0	111.6	I14 I27 L35 F43 T45 L46 H51 H52 H53	I14-L49 HydrophobicContact CD1-CD2 3.83Å; I27-L49 HydrophobicContact CG2-CD1 4.09Å; L35-L49 HydrophobicContact CB-CD1 3.83Å; F43-L49 HydrophobicContact CB-CB 4.1Å; F43-L49 HydrophobicContact CD2-CB 3.7Å; F43-L49 HydrophobicContact CD2-CD1 4.3Å; F43-L49 HydrophobicContact CD2-CG 3.98Å; F43-L49 HydrophobicContact CG-CB 4.1Å; T45-L49 PolarHBondContact O-N 3.1Å; L46-L49 PolarHBondContact O-N 2.6Å; L49-H51 VanDerWaalsContact C-N 3.34Å; L49-H52 PolarHBondContact O-N 2.84Å; L49-H53 PolarHBondContact O-CD2 2.84Å; L49-H53 VanDerWaalsContact O-CD2 3.25Å; L49-H53 PolarHBondContact O-N 3.42Å; L49-H53 VanDerWaalsContact O-N 3.1Å
50	V	98.4	Very high	98	Very high	47 Å²	47	62.2 Å²	62.2	29%	0.285	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-40.5	178.2	169.8	0	0	0	0	111	V2 L46 A47 E48 H53 S54 L64	V2-V50 HydrophobicContact CG2-CG2 3.94Å; L46-V50 HydrophobicContact CD1-CG2 4.49Å; L46-V50 VanDerWaalsContact O-CG2 3.3Å; L46-V50 WeakPolarHBondContact O-CG2 3.34Å; L46-V50 PolarHBondContact O-N 3.17Å; A47-V50 PolarHBondContact O-N 2.86Å; E48-V50 VanDerWaalsContact C-N 3.35Å; E48-V50 PolarHBondContact O-N 2.95Å; V50-H53 PolarHBondContact O-N 3.46Å; V50-S54 WeakPolarHBondContact O-CB 3.46Å; V50-S54 PolarHBondContact O-N 3.49Å; V50-L64 HydrophobicContact CG1-CD1 4.24Å
51	H	98.4	Very high	98.1	Very high	129 Å²	129	57.5 Å²	57.5	60%	0.597	33%	0.33	S	S	*	.	H	α-helix	trans	-63	-45.9	178.2	-176.6	63.3	0	0	0	111.6	A47 E48 L49 H53 S54	A47-H51 VanDerWaalsContact O-CB 3.31Å; A47-H51 WeakPolarHBondContact O-CB 3.14Å; A47-H51 PolarHBondContact O-N 3.49Å; E48-H51 PolarHBondContact O-N 2.89Å; L49-H51 VanDerWaalsContact C-N 3.34Å; H51-H53 PolarHBondContact O-N 3.06Å; H51-S54 WeakPolarHBondContact O-CB 3.39Å; H51-S54 PolarHBondContact O-N 3.17Å; H51-S54 VanDerWaalsContact O-N 3.1Å; H51-S54 PolarHBondContact O-OG 2.9Å
52	H	98.5	Very high	98.2	Very high	43 Å²	43	58.1 Å²	58.1	20%	0.199	33%	0.333	C	S	.	.	H	α-helix	trans	-56.8	-51.7	174.5	175.2	80.9	0	0	0	111.9	F43 E48 L49 S54 T55 V56 D58	F43-H52 HydrophobicContact CE1-CB 3.7Å; F43-H52 AromaticContact CE1-CG 3.9Å; F43-H52 HydrophobicContact CE2-CB 4Å; F43-H52 AromaticContact CE2-CD2 3.85Å; F43-H52 AromaticContact CE2-CG 3.97Å; F43-H52 HydrophobicContact CZ-CB 3.37Å; F43-H52 AromaticContact CZ-CD2 3.47Å; F43-H52 VanDerWaalsContact CZ-CD2 3.47Å; F43-H52 WeakPolarHBondContact CZ-CD2 3.27Å; F43-H52 AromaticContact CZ-CG 3.22Å; F43-H52 AromaticContact CZ-ND1 3.66Å; F43-H52 AromaticContact CZ-NE2 3.98Å; E48-H52 PolarHBondContact O-N 3.23Å; L49-H52 PolarHBondContact O-N 2.84Å; H52-S54 PolarHBondContact O-N 3.44Å; H52-S54 VanDerWaalsContact O-N 3.13Å; H52-T55 PolarHBondContact O-N 3.36Å; H52-T55 PolarHBondContact O-OG1 2.97Å; H52-V56 PolarHBondContact O-N 3.44Å; H52-V56 VanDerWaalsContact O-N 3.15Å; H52-D58 IonicContact CD2-OD2 2.77Å; H52-D58 IonicContact CE1-OD2 2.69Å; H52-D58 IonicContact NE2-OD2 3.98Å; H52-D58 PolarHBondContact NE2-OD2 3.21Å
53	H	98.6	Very high	98.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-70.8	-8.4	179.7	-72.7	-65.7	0	0	0	114	L49 V50 H51 V56 A57 D58 L60 T63 L64	L49-H53 PolarHBondContact O-CD2 2.84Å; L49-H53 VanDerWaalsContact O-CD2 3.25Å; L49-H53 PolarHBondContact O-N 3.42Å; L49-H53 VanDerWaalsContact O-N 3.1Å; V50-H53 PolarHBondContact O-N 3.46Å; H51-H53 PolarHBondContact O-N 3.06Å; H53-V56 CarbonylContact C-O 3.52Å; H53-V56 VanDerWaalsContact CA-O 3.26Å; H53-V56 WeakPolarHBondContact CA-O 3.45Å; H53-A57 PolarHBondContact ND1-O 3.31Å; H53-D58 PolarHBondContact CE1-O 3.19Å; H53-D58 VanDerWaalsContact CE1-O 3.29Å; H53-L60 HydrophobicContact CB-CD1 3.69Å; H53-T63 CarbonylContact O-C 3.42Å; H53-T63 WeakPolarHBondContact O-CA 3.44Å; H53-L64 HydrophobicContact CB-CD1 3.6Å; H53-L64 HydrophobicContact CB-CG 3.84Å; H53-L64 PolarHBondContact O-N 3.12Å
54	S	98.3	Very high	98.2	Very high	36 Å²	36	53.2 Å²	53.2	25%	0.252	32%	0.318	S	S	.	.	H	α-helix	trans	-78.6	-22.8	171	78.5	0	0	0	0	113	V50 H51 H52 L64	V50-S54 WeakPolarHBondContact O-CB 3.46Å; V50-S54 PolarHBondContact O-N 3.49Å; H51-S54 WeakPolarHBondContact O-CB 3.39Å; H51-S54 PolarHBondContact O-N 3.17Å; H51-S54 VanDerWaalsContact O-N 3.1Å; H51-S54 PolarHBondContact O-OG 2.9Å; H52-S54 PolarHBondContact O-N 3.44Å; H52-S54 VanDerWaalsContact O-N 3.13Å; S54-L64 VanDerWaalsContact CB-O 3.27Å; S54-L64 WeakPolarHBondContact CB-O 3.32Å
55	T	98.1	Very high	98.1	Very high	89 Å²	89	53.2 Å²	53.2	55%	0.546	31%	0.314	S	S	.	.	H	α-helix	trans	-101.5	-37.2	-179	65.2	0	0	0	0	112.6	H52	H52-T55 PolarHBondContact O-N 3.36Å; H52-T55 PolarHBondContact O-OG1 2.97Å
56	V	98.1	Very high	98	Very high	71 Å²	71	60.3 Å²	60.3	43%	0.43	34%	0.336	S	S	.	.			trans	-133.4	144.2	178.2	-66.3	0	0	0	0	110.7	H52 H53 D58	H52-V56 PolarHBondContact O-N 3.44Å; H52-V56 VanDerWaalsContact O-N 3.15Å; H53-V56 CarbonylContact C-O 3.52Å; H53-V56 VanDerWaalsContact CA-O 3.26Å; H53-V56 WeakPolarHBondContact CA-O 3.45Å; V56-D58 HydrophobicContact CG2-CB 4.1Å
57	A	98.1	Very high	98	Very high	32 Å²	32	63.5 Å²	63.5	26%	0.264	36%	0.36	S	S	.	.			trans	-68.4	-44.3	-177.5	0	0	0	0	0	111.9	H53 G59 L60	H53-A57 PolarHBondContact ND1-O 3.31Å; A57-G59 PolarHBondContact O-N 2.93Å; A57-L60 VanDerWaalsContact O-CB 3.29Å; A57-L60 WeakPolarHBondContact O-CB 3.31Å; A57-L60 WeakPolarHBondContact O-CG 3.45Å; A57-L60 PolarHBondContact O-N 2.98Å
58	D	97.4	Very high	97.9	Very high	52 Å²	52	62.5 Å²	62.5	28%	0.278	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.8	62.2	173.1	-173.3	25.6	0	0	0	114.4	S38 S41 H52 H53 V56 L60	S38-D58 PolarHBondContact OG-O 2.92Å; S41-D58 WeakPolarHBondContact CB-OD2 3.3Å; S41-D58 PolarHBondContact OG-OD2 3.11Å; H52-D58 IonicContact CD2-OD2 2.77Å; H52-D58 IonicContact CE1-OD2 2.69Å; H52-D58 IonicContact NE2-OD2 3.98Å; H52-D58 PolarHBondContact NE2-OD2 3.21Å; H53-D58 PolarHBondContact CE1-O 3.19Å; H53-D58 VanDerWaalsContact CE1-O 3.29Å; V56-D58 HydrophobicContact CG2-CB 4.1Å; D58-L60 VanDerWaalsContact C-N 3.35Å
59	G	96.6	Very high	97.7	Very high	60 Å²	60	63.3 Å²	63.3	62%	0.619	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	-13.1	-178.5	0	0	0	0	0	114.9	A57	A57-G59 PolarHBondContact O-N 2.93Å
60	L	98.2	Very high	97.4	Very high	13 Å²	13	73.2 Å²	73.2	7%	0.068	41%	0.407	C	S	.	.	S	Bend	trans	-78.6	159.2	163.6	-54.8	-175.7	0	0	0	111	L16 Y25 V37 H53 A57 D58 T62 L64	L16-L60 HydrophobicContact CD2-CB 4.35Å; L16-L60 HydrophobicContact CD2-CD1 4.42Å; Y25-L60 HydrophobicContact CD1-CD2 3.46Å; Y25-L60 VanDerWaalsContact CD1-CD2 3.46Å; Y25-L60 HydrophobicContact CD2-CD2 3.67Å; Y25-L60 HydrophobicContact CE1-CD2 3.68Å; Y25-L60 HydrophobicContact CE2-CD2 3.88Å; Y25-L60 HydrophobicContact CG-CD2 3.46Å; Y25-L60 VanDerWaalsContact CG-CD2 3.46Å; V37-L60 HydrophobicContact CB-CD2 4.45Å; V37-L60 HydrophobicContact CG1-CD2 3.84Å; V37-L60 HydrophobicContact CG2-CD2 4.41Å; H53-L60 HydrophobicContact CB-CD1 3.69Å; A57-L60 VanDerWaalsContact O-CB 3.29Å; A57-L60 WeakPolarHBondContact O-CB 3.31Å; A57-L60 WeakPolarHBondContact O-CG 3.45Å; A57-L60 PolarHBondContact O-N 2.98Å; D58-L60 VanDerWaalsContact C-N 3.35Å; L60-T62 VanDerWaalsContact C-N 3.26Å; L60-T62 WeakPolarHBondContact CB-O 3.35Å; L60-T62 PolarHBondContact O-N 3.23Å; L60-L64 HydrophobicContact CD1-CD1 4.44Å; L60-L64 HydrophobicContact CD1-CD2 3.94Å; L60-L64 HydrophobicContact CD1-CG 4.08Å
61	I	98.3	Very high	96.7	Very high	73 Å²	73	79.4 Å²	79.4	37%	0.374	43%	0.425	S	S	.	.	S	Bend	trans	-64.3	-29.9	174.6	-165.7	63.9	0	0	0	113	L16 Y18 Y23 Y25	L16-I61 HydrophobicContact CD2-CG2 3.94Å; L16-I61 HydrophobicContact CG-CG2 4.44Å; Y18-I61 HydrophobicContact CD1-CG1 3.7Å; Y18-I61 HydrophobicContact CE1-CG1 4.25Å; Y18-I61 HydrophobicContact CG-CG1 4.36Å; Y18-I61 HydrophobicContact CG-CG2 4.42Å; Y23-I61 HydrophobicContact CD2-CG2 3.78Å; Y23-I61 HydrophobicContact CE1-CG1 4.34Å; Y23-I61 HydrophobicContact CE2-CG1 4.26Å; Y23-I61 HydrophobicContact CE2-CG2 4.16Å; Y23-I61 HydrophobicContact CG-CB 4.5Å; Y23-I61 HydrophobicContact CG-CG2 3.98Å; Y25-I61 VanDerWaalsContact OH-CB 3.25Å; Y25-I61 WeakPolarHBondContact OH-CB 3.29Å; Y25-I61 VanDerWaalsContact OH-CG2 3.3Å; Y25-I61 WeakPolarHBondContact OH-CG2 3.29Å; Y25-I61 PolarHBondContact OH-N 2.8Å
62	T	98.6	Very high	96	Very high	36 Å²	36	76.4 Å²	76.4	22%	0.221	41%	0.414	C	S	.	.	S	Bend	trans	-160.6	176.4	176.7	-165.6	0	0	0	0	110.2	L16 Y18 L60	L16-T62 HydrophobicContact CD1-CG2 4.15Å; L16-T62 HydrophobicContact CD2-CG2 3.81Å; L16-T62 WeakPolarHBondContact CD2-O 3.37Å; L16-T62 HydrophobicContact CG-CG2 4.1Å; Y18-T62 HydrophobicContact CD2-CG2 3.68Å; Y18-T62 HydrophobicContact CE2-CG2 4.46Å; Y18-T62 HydrophobicContact CG-CG2 4.05Å; L60-T62 VanDerWaalsContact C-N 3.26Å; L60-T62 WeakPolarHBondContact CB-O 3.35Å; L60-T62 PolarHBondContact O-N 3.23Å
63	T	98.4	Very high	95.4	Very high	26 Å²	26	83.5 Å²	83.5	16%	0.16	44%	0.444	C	S	.	.			trans	-76.5	157.5	-179.7	48.3	0	0	0	0	113.6	H53 H65	H53-T63 CarbonylContact O-C 3.42Å; H53-T63 WeakPolarHBondContact O-CA 3.44Å; T63-H65 PolarHBondContact O-N 3.3Å; T63-H65 PolarHBondContact OG1-CD2 3.46Å; T63-H65 VanDerWaalsContact OG1-CD2 3.29Å; T63-H65 PolarHBondContact OG1-CE1 2.9Å; T63-H65 PolarHBondContact OG1-NE2 3.47Å
64	L	98.4	Very high	95	Very high	29 Å²	29	89.1 Å²	89.1	15%	0.152	48%	0.481	C	S	.	.			trans	-89.7	77.6	178.9	-56	-176.7	0	0	0	112	I14 L16 V50 H53 S54 L60	I14-L64 HydrophobicContact CD1-CD1 4.34Å; I14-L64 HydrophobicContact CG2-CD2 4.04Å; L16-L64 HydrophobicContact CD1-CD2 3.87Å; L16-L64 HydrophobicContact CD2-CD2 4.03Å; L16-L64 HydrophobicContact CG-CD2 4.39Å; V50-L64 HydrophobicContact CG1-CD1 4.24Å; H53-L64 HydrophobicContact CB-CD1 3.6Å; H53-L64 HydrophobicContact CB-CG 3.84Å; H53-L64 PolarHBondContact O-N 3.12Å; S54-L64 VanDerWaalsContact CB-O 3.27Å; S54-L64 WeakPolarHBondContact CB-O 3.32Å; L60-L64 HydrophobicContact CD1-CD1 4.44Å; L60-L64 HydrophobicContact CD1-CD2 3.94Å; L60-L64 HydrophobicContact CD1-CG 4.08Å
65	H	96.9	Very high	94.5	Very high	113 Å²	113	89.4 Å²	89.4	52%	0.523	48%	0.481	S	S	.	.			trans	-84.3	-43.3	-176.6	-68.2	168.5	0	0	0	115	T63	T63-H65 PolarHBondContact O-N 3.3Å; T63-H65 PolarHBondContact OG1-CD2 3.46Å; T63-H65 VanDerWaalsContact OG1-CD2 3.29Å; T63-H65 PolarHBondContact OG1-CE1 2.9Å; T63-H65 PolarHBondContact OG1-NE2 3.47Å
66	Y	97	Very high	94.1	Very high	209 Å²	209	90.6 Å²	90.6	82%	0.82	49%	0.488	S	S	*	.			trans	-124.4	111.6	-167	-55.2	-69.3	0	0	0	111.7	A68	Y66-A68 PolarHBondContact O-N 2.84Å
67	P	97.3	Very high	93.8	Very high	119 Å²	119	91.4 Å²	91.4	77%	0.773	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-59.8	134.2	170.7	-23.9	34.6	0	0	0	111.3
68	A	95.4	Very high	93.3	Very high	53 Å²	53	90.2 Å²	90.2	44%	0.438	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-65.7	129.2	175.9	0	0	0	0	0	109.9	L1 Y66	L1-A68 HydrophobicContact CB-CB 4.09Å; L1-A68 HydrophobicContact CD2-CB 4Å; Y66-A68 PolarHBondContact O-N 2.84Å
69	P	93.8	Very high	92.7	Very high	99 Å²	99	90.6 Å²	90.6	64%	0.643	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-63.6	136.2	-177.9	-23.3	33.2	0	0	0	112.9	R71	P69-R71 HydrophobicContact CB-CG 3.97Å; P69-R71 PolarHBondContact O-N 2.93Å
70	K	92.1	Very high	92.1	Very high	209 Å²	209	90 Å²	90	91%	0.909	46%	0.464	S	S	*	.			trans	-86.1	89.8	166	-66.6	-176	179.9	-176.9	0	108.7
71	R	84.8	Confident	91.4	Very high	176 Å²	176	95.5 Å²	95.5	66%	0.664	50%	0.501	S	S	*	.			trans	-78.6	-35	-170.2	-59.4	-173.6	177.8	-168.3	-1.9	113.8	P69 N225	P69-R71 HydrophobicContact CB-CG 3.97Å; P69-R71 PolarHBondContact O-N 2.93Å; R71-N225 WeakPolarHBondContact CB-ND2 3.28Å; R71-N225 WeakPolarHBondContact CD-OD1 3.25Å; R71-N225 PolarHBondContact NH1-OD1 2.81Å; R71-N225 VanDerWaalsContact NH1-OD1 3.16Å
72	N	84.1	Confident	90.9	Very high	66 Å²	66	96.9 Å²	96.9	35%	0.353	51%	0.51	S	S	.	.	S	Bend	trans	-96.1	133.7	-176.5	-65.3	-11.3	0	0	0	110.4	N225	N72-N225 PolarHBondContact OD1-ND2 3.28Å
73	K	85.8	Confident	90.1	Very high	193 Å²	193	105.5 Å²	105.5	84%	0.839	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-73.3	147.2	168.1	-65.7	179.3	-177.5	175.5	0	108.8
74	P	88.8	Confident	89.5	Confident	118 Å²	118	108.9 Å²	108.9	77%	0.766	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-53.8	142.8	169.7	-24.6	34.4	0	0	0	111.1	V76	P74-V76 PolarHBondContact O-N 3.09Å
75	T	89.2	Confident	89.2	Confident	42 Å²	42	113.9 Å²	113.9	26%	0.258	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-65.1	133.5	176.4	-55.4	0	0	0	0	110.2	Y77 Q151	T75-Y77 HydrophobicContact CG2-CD1 4.04Å; T75-Y77 HydrophobicContact CG2-CE1 3.73Å; T75-Q151 HydrophobicContact CG2-CG 3.66Å
76	V	89.3	Confident	89.1	Confident	114 Å²	114	110.2 Å²	110.2	69%	0.691	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-102.4	127.8	171.2	-175.2	0	0	0	0	107.6	P74 G78	P74-V76 PolarHBondContact O-N 3.09Å; V76-G78 WeakPolarHBondContact CG1-O 3.4Å; V76-G78 PolarHBondContact O-N 3.05Å
77	Y	91.3	Very high	89.1	Confident	88 Å²	88	103.3 Å²	103.3	35%	0.345	53%	0.534	S	S	.	.	S	Bend	trans	-90.3	96.9	-176.5	-57.9	-57.3	0	0	0	110.3	T75 K145 H146 P147 Q151	T75-Y77 HydrophobicContact CG2-CD1 4.04Å; T75-Y77 HydrophobicContact CG2-CE1 3.73Å; Y77-K145 HydrophobicContact CD1-CB 3.98Å; Y77-K145 HydrophobicContact CD1-CG 4.29Å; Y77-K145 HydrophobicContact CD2-CB 4.02Å; Y77-K145 HydrophobicContact CD2-CD 4.43Å; Y77-K145 HydrophobicContact CD2-CG 4.37Å; Y77-K145 HydrophobicContact CE1-CB 4.09Å; Y77-K145 HydrophobicContact CE2-CB 4.12Å; Y77-K145 HydrophobicContact CG-CB 3.93Å; Y77-K145 HydrophobicContact CG-CD 4.36Å; Y77-K145 HydrophobicContact CG-CG 4.01Å; Y77-H146 VanDerWaalsContact CE1-N 3.33Å; Y77-H146 WeakPolarHBondContact OH-CA 3.42Å; Y77-P147 WeakPolarHBondContact OH-CD 3.4Å; Y77-Q151 HydrophobicContact CD1-CG 4.14Å; Y77-Q151 HydrophobicContact CE1-CG 4.32Å
78	G	87.3	Confident	89	Confident	7 Å²	7	98.8 Å²	98.8	7%	0.072	50%	0.503	C	S	.	.	S	Bend	trans	84.4	-175.9	-170.7	0	0	0	0	0	113.1	V76	V76-G78 WeakPolarHBondContact CG1-O 3.4Å; V76-G78 PolarHBondContact O-N 3.05Å
79	V	84.9	Confident	89	Confident	59 Å²	59	102.2 Å²	102.2	36%	0.358	51%	0.51	S	S	.	.	S	Bend	trans	-116.5	-2.3	-175.7	-60.2	0	0	0	0	114.1	W112 L153	V79-W112 HydrophobicContact CG1-CH2 4.44Å; V79-W112 HydrophobicContact CG1-CZ3 4.02Å; V79-W112 HydrophobicContact CG2-CH2 3.65Å; V79-W112 HydrophobicContact CG2-CZ3 4.07Å; V79-L153 HydrophobicContact CG1-CB 4.42Å; V79-L153 HydrophobicContact CG1-CD2 4.12Å
80	S	85.1	Confident	89.1	Confident	47 Å²	47	100.3 Å²	100.3	33%	0.329	49%	0.49	S	S	.	.			trans	-124.2	139.4	-178.8	-169.5	0	0	0	0	110.7	N82	S80-N82 PolarHBondContact O-N 3.41Å; S80-N82 PolarHBondContact OG-N 3.26Å
81	P	83.7	Confident	89.3	Confident	130 Å²	130	95 Å²	95	84%	0.844	48%	0.475	S	S	*	.	S	Bend	trans	-74	-11.3	169.7	32.2	-35.5	0	0	0	112.6
82	N	85.9	Confident	89.9	Confident	102 Å²	102	88.8 Å²	88.8	55%	0.545	46%	0.455	S	S	.	.	S	Bend	trans	-83.7	145.7	-175.2	-64	-8.2	0	0	0	111.2	S80 D84 K85	S80-N82 PolarHBondContact O-N 3.41Å; S80-N82 PolarHBondContact OG-N 3.26Å; N82-D84 PolarHBondContact O-N 2.88Å; N82-K85 HydrophobicContact CB-CG 3.68Å
83	Y	82.7	Confident	90.6	Very high	217 Å²	217	86.2 Å²	86.2	85%	0.851	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	132	178.9	-171.4	-94.1	0	0	0	112.1	K85	Y83-K85 VanDerWaalsContact C-N 3.3Å; Y83-K85 PolarHBondContact O-N 2.8Å
84	D	86.4	Confident	91.1	Very high	96 Å²	96	79.8 Å²	79.8	51%	0.513	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	36.6	172.3	-160.7	36.6	0	0	0	115.5	N82 W86 K142	N82-D84 PolarHBondContact O-N 2.88Å; D84-W86 PolarHBondContact O-N 3.09Å; D84-W86 PolarHBondContact OD1-NE1 2.96Å; D84-K142 IonicContact OD1-NZ 2.64Å
85	K	92.6	Very high	91.5	Very high	134 Å²	134	77 Å²	77	58%	0.583	40%	0.396	S	S	*	.			trans	-93.6	72	174.7	-68.3	-58.1	-174.3	-177.1	0	112.4	N82 Y83	N82-K85 HydrophobicContact CB-CG 3.68Å; Y83-K85 VanDerWaalsContact C-N 3.3Å; Y83-K85 PolarHBondContact O-N 2.8Å
86	W	94.4	Very high	91.9	Very high	36 Å²	36	79.6 Å²	79.6	14%	0.136	40%	0.403	C	S	.	.			trans	-101.2	-30.2	178.4	-56.4	105.2	0	0	0	114.8	D84 M88 K142 L152 G154 V155	D84-W86 PolarHBondContact O-N 3.09Å; D84-W86 PolarHBondContact OD1-NE1 2.96Å; W86-M88 PolarHBondContact O-N 3.37Å; W86-K142 HydrophobicContact CD2-CG 4.09Å; W86-K142 HydrophobicContact CG-CD 4.12Å; W86-K142 HydrophobicContact CG-CG 4.08Å; W86-K142 HydrophobicContact CZ2-CB 4.31Å; W86-K142 HydrophobicContact CZ2-CG 4.35Å; W86-L152 HydrophobicContact CD2-CD2 4.05Å; W86-L152 HydrophobicContact CE3-CD2 3.75Å; W86-L152 HydrophobicContact CE3-CG 4.04Å; W86-L152 HydrophobicContact CZ3-CB 4.16Å; W86-L152 HydrophobicContact CZ3-CD2 4.04Å; W86-L152 HydrophobicContact CZ3-CG 4.12Å; W86-L152 WeakPolarHBondContact CZ3-O 3.24Å; W86-G154 CarbonylContact O-C 3.49Å; W86-G154 WeakPolarHBondContact O-CA 3.45Å; W86-V155 HydrophobicContact CB-CG2 4.02Å; W86-V155 PolarHBondContact O-N 3.42Å
87	E	96.1	Very high	92.1	Very high	65 Å²	65	79.6 Å²	79.6	30%	0.304	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-64.7	131.7	178	-81.1	-65.9	147	0	0	111.1	V155 T157 R158	E87-V155 WeakPolarHBondContact CA-O 3.48Å; E87-V155 HydrophobicContact CG-CG2 4.41Å; E87-V155 WeakPolarHBondContact OE1-CG2 3.48Å; E87-T157 WeakPolarHBondContact OE1-CB 3.38Å; E87-T157 PolarHBondContact OE1-N 3.27Å; E87-T157 PolarHBondContact OE1-OG1 3.39Å; E87-T157 PolarHBondContact OE2-N 3.02Å; E87-R158 IonicContact OE2-NE 3.82Å
88	M	95.1	Very high	92.2	Very high	23 Å²	23	80 Å²	80	11%	0.113	40%	0.399	C	S	.	.			trans	-131.4	163.8	178.2	70.5	174.6	76.9	0	0	112.4	W86 R90 I93 W112 V155 C156 I165	W86-M88 PolarHBondContact O-N 3.37Å; M88-R90 PolarHBondContact O-N 3.17Å; M88-I93 HydrophobicContact SD-CD1 3.86Å; M88-I93 HydrophobicContact SD-CG1 4.09Å; M88-W112 HydrophobicContact CB-CH2 4.42Å; M88-W112 HydrophobicContact CB-CZ2 4.05Å; M88-W112 HydrophobicContact CE-CE3 4.09Å; M88-W112 HydrophobicContact CE-CH2 3.2Å; M88-W112 HydrophobicContact CE-CZ2 3.79Å; M88-W112 HydrophobicContact CE-CZ3 3.38Å; M88-W112 HydrophobicContact SD-CD2 4.27Å; M88-W112 HydrophobicContact SD-CE3 4.31Å; M88-W112 HydrophobicContact SD-CH2 3.77Å; M88-W112 HydrophobicContact SD-CZ2 3.7Å; M88-W112 HydrophobicContact SD-CZ3 4.08Å; M88-V155 PolarHBondContact N-O 3.34Å; M88-C156 VanDerWaalsContact CG-SG 3.6Å; M88-C156 PolarHBondContact O-SG 3.27Å; M88-I165 HydrophobicContact CE-CB 3.89Å; M88-I165 HydrophobicContact CE-CD1 3.89Å; M88-I165 HydrophobicContact CE-CG1 4.01Å; M88-I165 HydrophobicContact CE-CG2 4.25Å; M88-I165 HydrophobicContact CG-CD1 4.31Å; M88-I165 HydrophobicContact SD-CB 4.41Å; M88-I165 HydrophobicContact SD-CD1 3.8Å; M88-I165 HydrophobicContact SD-CG1 3.93Å
89	E	95.8	Very high	92.2	Very high	125 Å²	125	83.3 Å²	83.3	58%	0.584	42%	0.415	S	S	*	.			trans	-77	119.8	176.7	-66.4	-174.6	-171.4	0	0	110.6	T91 D92	E89-T91 PolarHBondContact O-N 3.09Å; E89-T91 VanDerWaalsContact O-N 3.16Å; E89-D92 WeakPolarHBondContact O-CB 3.47Å; E89-D92 PolarHBondContact O-N 3.37Å
90	R	95.6	Very high	92	Very high	60 Å²	60	82 Å²	82	23%	0.226	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-56.2	-34.2	178.9	-174.9	-176.1	-65.1	132.2	10.6	112.2	M88 D92 I93 E159 P160 P161 Y163	M88-R90 PolarHBondContact O-N 3.17Å; R90-D92 PolarHBondContact O-N 2.96Å; R90-I93 WeakPolarHBondContact O-CB 3.45Å; R90-I93 PolarHBondContact O-N 3.1Å; R90-E159 PolarHBondContact NH2-O 3.44Å; R90-P160 PolarHBondContact NH1-O 3.4Å; R90-P160 PolarHBondContact NH2-O 2.64Å; R90-P161 PolarHBondContact NE-O 3.25Å; R90-P161 PolarHBondContact NH2-O 3.49Å; R90-Y163 HydrophobicContact CG-CD2 4.03Å; R90-Y163 HydrophobicContact CG-CE2 3.55Å
91	T	96.7	Very high	91.1	Very high	98 Å²	98	82.4 Å²	82.4	60%	0.601	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-61.4	-20.2	178.5	43.3	0	0	0	0	113.7	E89 I93 K113	E89-T91 PolarHBondContact O-N 3.09Å; E89-T91 VanDerWaalsContact O-N 3.16Å; T91-I93 VanDerWaalsContact C-N 3.27Å; T91-K113 PolarHBondContact O-NZ 2.74Å
92	D	97.1	Very high	90.1	Very high	44 Å²	44	77.9 Å²	77.9	24%	0.235	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-78	-10.5	173.9	-76.2	-10	0	0	0	113.3	E89 R90 K113	E89-D92 WeakPolarHBondContact O-CB 3.47Å; E89-D92 PolarHBondContact O-N 3.37Å; R90-D92 PolarHBondContact O-N 2.96Å; D92-K113 WeakPolarHBondContact O-CB 3.39Å; D92-K113 WeakPolarHBondContact O-CG 3.28Å; D92-K113 PolarHBondContact O-N 3.46Å
93	I	98	Very high	88.7	Confident	13 Å²	13	78.9 Å²	78.9	7%	0.067	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	118.5	-179.6	-58	-62.4	0	0	0	109.7	M88 R90 T91 M95 W112 V119 V121 Y163 I165	M88-I93 HydrophobicContact SD-CD1 3.86Å; M88-I93 HydrophobicContact SD-CG1 4.09Å; R90-I93 WeakPolarHBondContact O-CB 3.45Å; R90-I93 PolarHBondContact O-N 3.1Å; T91-I93 VanDerWaalsContact C-N 3.27Å; I93-M95 HydrophobicContact CG2-SD 4.08Å; I93-W112 HydrophobicContact CD1-CB 3.91Å; I93-W112 HydrophobicContact CD1-CD2 4.26Å; I93-W112 HydrophobicContact CD1-CG 3.88Å; I93-V119 HydrophobicContact CD1-CG2 4.5Å; I93-V121 HydrophobicContact CG2-CG2 3.87Å; I93-Y163 HydrophobicContact CG2-CE2 4.48Å; I93-I165 HydrophobicContact CD1-CG1 4.37Å
94	T	97.9	Very high	87.5	Confident	58 Å²	58	69.2 Å²	69.2	36%	0.356	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	111.4	166.5	-53.4	0	0	0	0	108.5	G110 V111 K113	T94-G110 CarbonylContact O-C 3.58Å; T94-G110 WeakPolarHBondContact O-CA 3.32Å; T94-V111 PolarHBondContact N-O 3.4Å; T94-V111 PolarHBondContact O-N 3.38Å; T94-K113 WeakPolarHBondContact OG1-CE 3.45Å
95	M	97.1	Very high	86.8	Confident	60 Å²	60	64.8 Å²	64.8	30%	0.296	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	139	171.2	-60.4	-65.3	-81.7	0	0	110.2	I93 Y108 V121 Y163	I93-M95 HydrophobicContact CG2-SD 4.08Å; M95-Y108 HydrophobicContact CE-CD1 4.31Å; M95-Y108 HydrophobicContact CE-CD2 3.47Å; M95-Y108 VanDerWaalsContact CE-CD2 3.47Å; M95-Y108 HydrophobicContact CE-CE2 4.23Å; M95-Y108 HydrophobicContact CE-CG 3.53Å; M95-V121 HydrophobicContact CE-CB 4.17Å; M95-V121 HydrophobicContact CE-CG1 4.03Å; M95-V121 HydrophobicContact SD-CB 3.85Å; M95-V121 HydrophobicContact SD-CG1 3.73Å; M95-V121 HydrophobicContact SD-CG2 4.08Å; M95-Y163 HydrophobicContact SD-CE2 4.09Å
96	K	96.8	Very high	86.5	Confident	95 Å²	95	60.5 Å²	60.5	41%	0.413	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	-140.9	174.7	-64.5	176.7	165	176.7	0	110.2	E109 V111	K96-E109 WeakPolarHBondContact CA-O 3.34Å; K96-E109 HydrophobicContact CB-CB 4.24Å; K96-E109 VanDerWaalsContact CB-O 3.32Å; K96-E109 WeakPolarHBondContact CB-O 3.45Å; K96-E109 HydrophobicContact CD-CG 4.12Å; K96-E109 WeakPolarHBondContact CD-OE1 3.48Å; K96-E109 PolarHBondContact N-O 2.99Å; K96-E109 IonicContact NZ-OE1 2.65Å; K96-E109 PolarHBondContact NZ-OE1 3.16Å; K96-V111 HydrophobicContact CD-CG2 4.16Å
97	H	93.8	Very high	86.4	Confident	115 Å²	115	60.6 Å²	60.6	53%	0.532	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	156.6	-178.1	67.8	-88.3	0	0	0	111.3	E109	H97-E109 IonicContact CE1-OE2 2.67Å; H97-E109 PolarHBondContact CE1-OE2 2.93Å; H97-E109 IonicContact ND1-OE2 3.12Å; H97-E109 IonicContact NE2-OE2 2.77Å; H97-E109 PolarHBondContact O-N 3.34Å
98	K	93.4	Very high	86.3	Confident	97 Å²	97	59.9 Å²	59.9	42%	0.422	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	131.1	178.4	-173.2	173.2	177.4	175.2	0	110.1	G100 E106 Y108	K98-G100 WeakPolarHBondContact CE-O 3.44Å; K98-E106 IonicContact NZ-OE1 2.66Å; K98-E106 PolarHBondContact NZ-OE1 3.37Å; K98-Y108 HydrophobicContact CB-CD1 4Å; K98-Y108 HydrophobicContact CB-CE1 3.87Å; K98-Y108 HydrophobicContact CG-CE1 4.29Å
99	L	87.9	Confident	86.4	Confident	76 Å²	76	60 Å²	60	40%	0.398	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-35.9	175.4	-65.2	170.2	0	0	0	111.3	V107 E109 A120 F168	L99-V107 HydrophobicContact CB-CG1 4.49Å; L99-V107 HydrophobicContact CD1-CG1 4.27Å; L99-V107 PolarHBondContact N-O 3.39Å; L99-E109 HydrophobicContact CD1-CB 4.2Å; L99-E109 HydrophobicContact CD2-CB 4.11Å; L99-E109 HydrophobicContact CG-CB 4.14Å; L99-A120 HydrophobicContact CD1-CB 4.35Å; L99-F168 HydrophobicContact CD1-CD2 4.05Å; L99-F168 HydrophobicContact CD1-CE2 3.65Å; L99-F168 HydrophobicContact CD2-CE2 3.87Å; L99-F168 HydrophobicContact CD2-CZ 4.44Å; L99-F168 HydrophobicContact CG-CE2 4.42Å
100	G	79.6	Confident	86.5	Confident	32 Å²	32	54 Å²	54	33%	0.33	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.9	-178.2	-177.9	0	0	0	0	0	112.6	K98 V107	K98-G100 WeakPolarHBondContact CE-O 3.44Å; G100-V107 PolarHBondContact N-O 3.44Å; G100-V107 PolarHBondContact O-N 3.43Å
101	G	66.9	Low	86.6	Confident	55 Å²	55	52.6 Å²	52.6	57%	0.567	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	121.3	172.3	0	0	0	0	0	109.3
102	G	62.1	Low	86.7	Confident	34 Å²	34	48.5 Å²	48.5	35%	0.351	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-173.9	174	0	0	0	0	0	111.4	Y104 G105	G102-Y104 PolarHBondContact O-N 2.87Å; G102-G105 PolarHBondContact N-O 3.22Å
103	Q	56.5	Low	86.6	Confident	124 Å²	124	51.7 Å²	51.7	58%	0.579	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-34.1	177.5	-175.8	172	-16.4	0	0	112.4
104	Y	56.9	Low	86.4	Confident	13 Å²	13	57.9 Å²	57.9	5%	0.051	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	8.5	-168.2	-54.8	-69.9	0	0	0	115.5	G102 E130 E133 L235	G102-Y104 PolarHBondContact O-N 2.87Å; Y104-E130 WeakPolarHBondContact CD1-OE2 3.47Å; Y104-E133 WeakPolarHBondContact CE1-OE2 3.33Å; Y104-L235 HydrophobicContact CE2-CD2 4.3Å; Y104-L235 HydrophobicContact CE2-CG 3.98Å; Y104-L235 WeakPolarHBondContact OH-CD2 3.39Å
105	G	72.4	Confident	86.1	Confident	3 Å²	3	60.6 Å²	60.6	3%	0.031	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.5	-177.7	-179.5	0	0	0	0	0	115.2	G102 T123	G102-G105 PolarHBondContact N-O 3.22Å; G105-T123 WeakPolarHBondContact CA-O 3.36Å
106	E	86.5	Confident	86	Confident	44 Å²	44	62.7 Å²	62.7	21%	0.206	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	134.7	-179	-61.5	-172.1	118.1	0	0	109.7	K98 Y108 K122 T123 K125	K98-E106 IonicContact NZ-OE1 2.66Å; K98-E106 PolarHBondContact NZ-OE1 3.37Å; E106-Y108 HydrophobicContact CB-CD2 4.3Å; E106-Y108 HydrophobicContact CB-CE2 3.46Å; E106-Y108 VanDerWaalsContact CB-CE2 3.46Å; E106-Y108 PolarHBondContact OE2-OH 3.44Å; E106-K122 WeakPolarHBondContact O-CA 3.16Å; E106-T123 HydrophobicContact CB-CG2 4.29Å; E106-T123 PolarHBondContact N-O 3.01Å; E106-T123 PolarHBondContact O-N 3.29Å; E106-K125 HydrophobicContact CG-CD 4.34Å; E106-K125 HydrophobicContact CG-CG 3.88Å
107	V	91.4	Very high	85.9	Confident	38 Å²	38	61.5 Å²	61.5	23%	0.23	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	128	-179.6	-173.2	0	0	0	0	108.7	L99 G100 A120 V121 K122	L99-V107 HydrophobicContact CB-CG1 4.49Å; L99-V107 HydrophobicContact CD1-CG1 4.27Å; L99-V107 PolarHBondContact N-O 3.39Å; G100-V107 PolarHBondContact N-O 3.44Å; G100-V107 PolarHBondContact O-N 3.43Å; V107-A120 HydrophobicContact CG1-CB 4.32Å; V107-V121 WeakPolarHBondContact CA-O 3.4Å; V107-K122 HydrophobicContact CG2-CB 4.27Å; V107-K122 HydrophobicContact CG2-CG 4.07Å
108	Y	94.8	Very high	86.1	Confident	50 Å²	50	58.6 Å²	58.6	20%	0.196	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	150.1	-179.1	-64.4	-99.2	0	0	0	110.7	M95 K98 E106 A120 V121 T123	M95-Y108 HydrophobicContact CE-CD1 4.31Å; M95-Y108 HydrophobicContact CE-CD2 3.47Å; M95-Y108 VanDerWaalsContact CE-CD2 3.47Å; M95-Y108 HydrophobicContact CE-CE2 4.23Å; M95-Y108 HydrophobicContact CE-CG 3.53Å; K98-Y108 HydrophobicContact CB-CD1 4Å; K98-Y108 HydrophobicContact CB-CE1 3.87Å; K98-Y108 HydrophobicContact CG-CE1 4.29Å; E106-Y108 HydrophobicContact CB-CD2 4.3Å; E106-Y108 HydrophobicContact CB-CE2 3.46Å; E106-Y108 VanDerWaalsContact CB-CE2 3.46Å; E106-Y108 PolarHBondContact OE2-OH 3.44Å; Y108-A120 WeakPolarHBondContact O-CA 3.25Å; Y108-V121 PolarHBondContact N-O 3.47Å; Y108-V121 PolarHBondContact O-N 3.03Å; Y108-T123 HydrophobicContact CD2-CG2 4.04Å; Y108-T123 HydrophobicContact CE2-CG2 3.65Å
109	E	97.1	Very high	86.3	Confident	26 Å²	26	54 Å²	54	12%	0.121	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	138.2	159.1	-169.7	-169	131.7	0	0	107.5	K96 H97 L99 T118 F168	K96-E109 WeakPolarHBondContact CA-O 3.34Å; K96-E109 HydrophobicContact CB-CB 4.24Å; K96-E109 VanDerWaalsContact CB-O 3.32Å; K96-E109 WeakPolarHBondContact CB-O 3.45Å; K96-E109 HydrophobicContact CD-CG 4.12Å; K96-E109 WeakPolarHBondContact CD-OE1 3.48Å; K96-E109 PolarHBondContact N-O 2.99Å; K96-E109 IonicContact NZ-OE1 2.65Å; K96-E109 PolarHBondContact NZ-OE1 3.16Å; H97-E109 IonicContact CE1-OE2 2.67Å; H97-E109 PolarHBondContact CE1-OE2 2.93Å; H97-E109 IonicContact ND1-OE2 3.12Å; H97-E109 IonicContact NE2-OE2 2.77Å; H97-E109 PolarHBondContact O-N 3.34Å; L99-E109 HydrophobicContact CD1-CB 4.2Å; L99-E109 HydrophobicContact CD2-CB 4.11Å; L99-E109 HydrophobicContact CG-CB 4.14Å; E109-T118 HydrophobicContact CG-CG2 3.78Å; E109-F168 HydrophobicContact CG-CD2 4.46Å; E109-F168 HydrophobicContact CG-CE2 4.2Å
110	G	97.8	Very high	86.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	165.3	173.9	0	0	0	0	0	111.9	T94 T118 V119	T94-G110 CarbonylContact O-C 3.58Å; T94-G110 WeakPolarHBondContact O-CA 3.32Å; G110-T118 WeakPolarHBondContact O-CA 3.41Å; G110-V119 PolarHBondContact N-O 3.34Å; G110-V119 PolarHBondContact O-N 2.6Å
111	V	98.3	Very high	87.5	Confident	30 Å²	30	49.3 Å²	49.3	18%	0.182	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	122.3	169.6	174.2	0	0	0	0	109.1	T94 K96 K113 L117	T94-V111 PolarHBondContact N-O 3.4Å; T94-V111 PolarHBondContact O-N 3.38Å; K96-V111 HydrophobicContact CD-CG2 4.16Å; V111-K113 PolarHBondContact O-N 2.75Å; V111-L117 CarbonylContact C-O 3.59Å; V111-L117 WeakPolarHBondContact CA-O 3.43Å
112	W	97.4	Very high	88.7	Confident	12 Å²	12	47.6 Å²	47.6	5%	0.045	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	100.9	168	-165.4	-10.8	0	0	0	109.3	V79 M88 I93 K114 Y115 S116 L117 V119 L153	V79-W112 HydrophobicContact CG1-CH2 4.44Å; V79-W112 HydrophobicContact CG1-CZ3 4.02Å; V79-W112 HydrophobicContact CG2-CH2 3.65Å; V79-W112 HydrophobicContact CG2-CZ3 4.07Å; M88-W112 HydrophobicContact CB-CH2 4.42Å; M88-W112 HydrophobicContact CB-CZ2 4.05Å; M88-W112 HydrophobicContact CE-CE3 4.09Å; M88-W112 HydrophobicContact CE-CH2 3.2Å; M88-W112 HydrophobicContact CE-CZ2 3.79Å; M88-W112 HydrophobicContact CE-CZ3 3.38Å; M88-W112 HydrophobicContact SD-CD2 4.27Å; M88-W112 HydrophobicContact SD-CE3 4.31Å; M88-W112 HydrophobicContact SD-CH2 3.77Å; M88-W112 HydrophobicContact SD-CZ2 3.7Å; M88-W112 HydrophobicContact SD-CZ3 4.08Å; I93-W112 HydrophobicContact CD1-CB 3.91Å; I93-W112 HydrophobicContact CD1-CD2 4.26Å; I93-W112 HydrophobicContact CD1-CG 3.88Å; W112-K114 VanDerWaalsContact C-N 3.3Å; W112-K114 PolarHBondContact O-N 3.13Å; W112-Y115 AromaticContact CD2-CD2 3.88Å; W112-Y115 HydrophobicContact CD2-CD2 3.88Å; W112-Y115 HydrophobicContact CD2-CE2 4.18Å; W112-Y115 AromaticContact CE2-CD2 3.99Å; W112-Y115 AromaticContact CE2-CE2 3.86Å; W112-Y115 HydrophobicContact CE3-CD2 4.32Å; W112-Y115 HydrophobicContact CG-CD2 4.09Å; W112-Y115 HydrophobicContact CH2-CE2 4.38Å; W112-Y115 AromaticContact CZ2-CE2 3.99Å; W112-Y115 HydrophobicContact CZ2-CE2 3.99Å; W112-Y115 PolarHBondContact O-N 3.11Å; W112-S116 PolarHBondContact O-N 2.9Å; W112-L117 HydrophobicContact CB-CB 4.44Å; W112-L117 PolarHBondContact N-O 3.31Å; W112-L117 PolarHBondContact O-N 3.32Å; W112-V119 HydrophobicContact CB-CG1 4.3Å; W112-L153 HydrophobicContact CZ3-CB 4.05Å
113	K	96	Very high	90.1	Very high	111 Å²	111	46.6 Å²	46.6	48%	0.483	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-52.9	-44.3	-171.6	-66.4	172.6	-170.9	167.7	0	112.9	T91 D92 T94 V111 Y115 S116	T91-K113 PolarHBondContact O-NZ 2.74Å; D92-K113 WeakPolarHBondContact O-CB 3.39Å; D92-K113 WeakPolarHBondContact O-CG 3.28Å; D92-K113 PolarHBondContact O-N 3.46Å; T94-K113 WeakPolarHBondContact OG1-CE 3.45Å; V111-K113 PolarHBondContact O-N 2.75Å; K113-Y115 PolarHBondContact O-N 2.72Å; K113-Y115 VanDerWaalsContact O-N 3.11Å; K113-S116 PolarHBondContact O-N 3.1Å
114	K	92.9	Very high	91.3	Very high	143 Å²	143	41.8 Å²	41.8	62%	0.622	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-54.7	-32.7	-177.1	-174.6	173.6	-178.2	176.2	0	113.8	W112	W112-K114 VanDerWaalsContact C-N 3.3Å; W112-K114 PolarHBondContact O-N 3.13Å
115	Y	92.3	Very high	92	Very high	115 Å²	115	45.8 Å²	45.8	45%	0.451	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-115.2	-0.2	-177.1	-57.4	-72.6	0	0	0	113	W112 K113 L117	W112-Y115 AromaticContact CD2-CD2 3.88Å; W112-Y115 HydrophobicContact CD2-CD2 3.88Å; W112-Y115 HydrophobicContact CD2-CE2 4.18Å; W112-Y115 AromaticContact CE2-CD2 3.99Å; W112-Y115 AromaticContact CE2-CE2 3.86Å; W112-Y115 HydrophobicContact CE3-CD2 4.32Å; W112-Y115 HydrophobicContact CG-CD2 4.09Å; W112-Y115 HydrophobicContact CH2-CE2 4.38Å; W112-Y115 AromaticContact CZ2-CE2 3.99Å; W112-Y115 HydrophobicContact CZ2-CE2 3.99Å; W112-Y115 PolarHBondContact O-N 3.11Å; K113-Y115 PolarHBondContact O-N 2.72Å; K113-Y115 VanDerWaalsContact O-N 3.11Å; Y115-L117 PolarHBondContact O-N 3.33Å
116	S	95.1	Very high	91.7	Very high	103 Å²	103	53.8 Å²	53.8	72%	0.72	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.6	40.2	-165.5	-62.7	0	0	0	0	112.2	W112 K113	W112-S116 PolarHBondContact O-N 2.9Å; K113-S116 PolarHBondContact O-N 3.1Å
117	L	95.4	Very high	90.7	Very high	71 Å²	71	59.9 Å²	59.9	37%	0.372	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	129.6	-173.2	-179.8	65.5	0	0	0	110.3	V111 W112 Y115 V119 L153	V111-L117 CarbonylContact C-O 3.59Å; V111-L117 WeakPolarHBondContact CA-O 3.43Å; W112-L117 HydrophobicContact CB-CB 4.44Å; W112-L117 PolarHBondContact N-O 3.31Å; W112-L117 PolarHBondContact O-N 3.32Å; Y115-L117 PolarHBondContact O-N 3.33Å; L117-V119 HydrophobicContact CD2-CG1 4.14Å; L117-V119 HydrophobicContact CG-CG1 4.07Å; L117-L153 HydrophobicContact CD2-CD1 4Å
118	T	97.8	Very high	89.4	Confident	53 Å²	53	60.3 Å²	60.3	33%	0.325	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	131.8	171.4	-53.7	0	0	0	0	109.4	E109 G110 F168	E109-T118 HydrophobicContact CG-CG2 3.78Å; G110-T118 WeakPolarHBondContact O-CA 3.41Å; T118-F168 HydrophobicContact CG2-CB 4.01Å; T118-F168 HydrophobicContact CG2-CD1 3.69Å; T118-F168 HydrophobicContact CG2-CD2 4.34Å; T118-F168 HydrophobicContact CG2-CE1 4.22Å; T118-F168 HydrophobicContact CG2-CG 3.75Å; T118-F168 WeakPolarHBondContact O-CB 3.17Å
119	V	97.7	Very high	87.8	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	159	-174.1	-64.1	0	0	0	0	110.7	I93 G110 W112 L117 V121 L153 I165 T166	I93-V119 HydrophobicContact CD1-CG2 4.5Å; G110-V119 PolarHBondContact N-O 3.34Å; G110-V119 PolarHBondContact O-N 2.6Å; W112-V119 HydrophobicContact CB-CG1 4.3Å; L117-V119 HydrophobicContact CD2-CG1 4.14Å; L117-V119 HydrophobicContact CG-CG1 4.07Å; V119-V121 HydrophobicContact CG2-CG2 3.91Å; V119-L153 HydrophobicContact CG1-CD1 3.69Å; V119-I165 HydrophobicContact CB-CG2 3.77Å; V119-I165 HydrophobicContact CG1-CG2 4.02Å; V119-I165 HydrophobicContact CG2-CG2 3.87Å; V119-T166 WeakPolarHBondContact CB-O 3.41Å
120	A	96.4	Very high	86.6	Confident	11 Å²	11	69.3 Å²	69.3	9%	0.091	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	128.8	166.6	0	0	0	0	0	109.4	L99 V107 Y108 T166 F168	L99-A120 HydrophobicContact CD1-CB 4.35Å; V107-A120 HydrophobicContact CG1-CB 4.32Å; Y108-A120 WeakPolarHBondContact O-CA 3.25Å; A120-T166 PolarHBondContact N-O 3.2Å; A120-T166 PolarHBondContact O-N 3.22Å; A120-T166 PolarHBondContact O-OG1 3.24Å; A120-F168 HydrophobicContact CB-CD2 4.46Å
121	V	95.4	Very high	85.9	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	112.6	-176.8	-172.5	0	0	0	0	109	I93 M95 V107 Y108 V119 Y163 I164 I165	I93-V121 HydrophobicContact CG2-CG2 3.87Å; M95-V121 HydrophobicContact CE-CB 4.17Å; M95-V121 HydrophobicContact CE-CG1 4.03Å; M95-V121 HydrophobicContact SD-CB 3.85Å; M95-V121 HydrophobicContact SD-CG1 3.73Å; M95-V121 HydrophobicContact SD-CG2 4.08Å; V107-V121 WeakPolarHBondContact CA-O 3.4Å; Y108-V121 PolarHBondContact N-O 3.47Å; Y108-V121 PolarHBondContact O-N 3.03Å; V119-V121 HydrophobicContact CG2-CG2 3.91Å; V121-Y163 HydrophobicContact CG1-CD1 4Å; V121-Y163 HydrophobicContact CG1-CD2 3.75Å; V121-Y163 HydrophobicContact CG1-CE1 4.47Å; V121-Y163 HydrophobicContact CG1-CE2 4.19Å; V121-Y163 HydrophobicContact CG1-CG 3.66Å; V121-I164 WeakPolarHBondContact CA-O 3.37Å; V121-I165 HydrophobicContact CG1-CG1 4.45Å; V121-I165 HydrophobicContact CG2-CG1 4.39Å
122	K	92.4	Very high	85.2	Confident	18 Å²	18	77 Å²	77	8%	0.078	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	126.6	170.7	-169.2	179.6	-170.2	177	0	108.7	E106 V107 F134 E137 Y163 I164	E106-K122 WeakPolarHBondContact O-CA 3.16Å; V107-K122 HydrophobicContact CG2-CB 4.27Å; V107-K122 HydrophobicContact CG2-CG 4.07Å; K122-F134 HydrophobicContact CD-CE2 4.44Å; K122-F134 HydrophobicContact CG-CE2 4.14Å; K122-E137 IonicContact NZ-OE1 3.48Å; K122-E137 PolarHBondContact NZ-OE1 3.18Å; K122-E137 IonicContact NZ-OE2 3.53Å; K122-E137 PolarHBondContact NZ-OE2 3.44Å; K122-Y163 WeakPolarHBondContact O-CA 3.5Å; K122-I164 HydrophobicContact CB-CB 4.3Å; K122-I164 PolarHBondContact N-O 2.68Å; K122-I164 PolarHBondContact O-N 3.07Å
123	T	91	Very high	84.3	Confident	14 Å²	14	78.8 Å²	78.8	9%	0.086	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	144.8	174.8	-174.1	0	0	0	0	110.6	G105 E106 Y108 F162 Y163	G105-T123 WeakPolarHBondContact CA-O 3.36Å; E106-T123 HydrophobicContact CB-CG2 4.29Å; E106-T123 PolarHBondContact N-O 3.01Å; E106-T123 PolarHBondContact O-N 3.29Å; Y108-T123 HydrophobicContact CD2-CG2 4.04Å; Y108-T123 HydrophobicContact CE2-CG2 3.65Å; T123-F162 WeakPolarHBondContact CA-O 3.46Å; T123-Y163 WeakPolarHBondContact OG1-CE1 3.47Å
124	L	81.9	Confident	83.7	Confident	22 Å²	22	73.6 Å²	73.6	12%	0.115	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-70.5	140.2	171.7	-165.7	71.7	0	0	0	109.4	T128 E130 V131 F134	L124-T128 WeakPolarHBondContact CD1-OG1 3.31Å; L124-T128 VanDerWaalsContact CG-OG1 3.23Å; L124-T128 WeakPolarHBondContact CG-OG1 3.5Å; L124-E130 HydrophobicContact CD1-CB 4.48Å; L124-V131 HydrophobicContact CD2-CB 4.46Å; L124-V131 HydrophobicContact CD2-CG2 3.59Å; L124-F134 HydrophobicContact CB-CD2 4.28Å; L124-F134 HydrophobicContact CB-CE2 4.45Å; L124-F134 HydrophobicContact CD1-CB 4.17Å; L124-F134 HydrophobicContact CD1-CD2 4.14Å; L124-F134 HydrophobicContact CD1-CG 4.39Å
125	K	72.2	Confident	83.4	Confident	98 Å²	98	70 Å²	70	43%	0.426	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-70.1	138.1	172	-72.7	179.4	-179.7	172.4	0	109.7	E106 D127 T128	E106-K125 HydrophobicContact CG-CD 4.34Å; E106-K125 HydrophobicContact CG-CG 3.88Å; K125-D127 PolarHBondContact O-N 2.88Å; K125-T128 HydrophobicContact CB-CG2 3.94Å; K125-T128 PolarHBondContact O-N 3.08Å; K125-T128 PolarHBondContact O-OG1 2.9Å
126	E	66.5	Low	83	Confident	171 Å²	171	69.4 Å²	69.4	80%	0.799	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	135.3	166.7	-66	178.9	172.6	0	0	108.1
127	D	64.9	Low	82.6	Confident	171 Å²	171	65 Å²	65	91%	0.914	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	14.5	-177.6	-48.9	-37.4	0	0	0	118.7	K125	K125-D127 PolarHBondContact O-N 2.88Å
128	T	64.3	Low	82.2	Confident	48 Å²	48	61.9 Å²	61.9	29%	0.294	31%	0.31	S	S	.	.			trans	-97.1	133.1	171.3	57.8	0	0	0	0	112.4	L124 K125 E130	L124-T128 WeakPolarHBondContact CD1-OG1 3.31Å; L124-T128 VanDerWaalsContact CG-OG1 3.23Å; L124-T128 WeakPolarHBondContact CG-OG1 3.5Å; K125-T128 HydrophobicContact CB-CG2 3.94Å; K125-T128 PolarHBondContact O-N 3.08Å; K125-T128 PolarHBondContact O-OG1 2.9Å; T128-E130 PolarHBondContact O-N 2.97Å
129	M	60.3	Low	81.7	Confident	195 Å²	195	61.9 Å²	61.9	96%	0.961	32%	0.316	S	S	*	.	S	Bend	trans	-78.1	11.7	174	-62.1	-172.1	85.7	0	0	113	V131	M129-V131 VanDerWaalsContact C-N 3.32Å; M129-V131 PolarHBondContact O-N 2.91Å
130	E	73.4	Confident	81.1	Confident	70 Å²	70	63 Å²	63	33%	0.327	32%	0.322	S	S	.	.			trans	-92.4	20.2	-169.1	-61.2	-172.5	170	0	0	113.9	Y104 L124 T128 E132 E133 F134	Y104-E130 WeakPolarHBondContact CD1-OE2 3.47Å; L124-E130 HydrophobicContact CD1-CB 4.48Å; T128-E130 PolarHBondContact O-N 2.97Å; E130-E132 PolarHBondContact O-N 3Å; E130-E133 PolarHBondContact O-N 2.97Å; E130-F134 PolarHBondContact O-N 3.07Å
131	V	81.8	Confident	80.8	Confident	54 Å²	54	62.9 Å²	62.9	33%	0.327	32%	0.32	S	S	.	.	H	α-helix	trans	-52.6	-42.8	178.9	171.7	0	0	0	0	111.9	L124 M129 E133 F134 L135 F162	L124-V131 HydrophobicContact CD2-CB 4.46Å; L124-V131 HydrophobicContact CD2-CG2 3.59Å; M129-V131 VanDerWaalsContact C-N 3.32Å; M129-V131 PolarHBondContact O-N 2.91Å; V131-E133 VanDerWaalsContact C-N 3.34Å; V131-E133 PolarHBondContact O-N 2.86Å; V131-F134 PolarHBondContact O-N 3.49Å; V131-L135 HydrophobicContact CG1-CD1 3.92Å; V131-L135 HydrophobicContact CG1-CG 4.3Å; V131-L135 WeakPolarHBondContact O-CG 3.48Å; V131-L135 PolarHBondContact O-N 3.19Å; V131-F162 HydrophobicContact CG1-CD2 4.16Å; V131-F162 HydrophobicContact CG1-CE2 3.61Å; V131-F162 HydrophobicContact CG2-CE2 4.39Å
132	E	82.9	Confident	80.6	Confident	136 Å²	136	65.5 Å²	65.5	64%	0.636	33%	0.332	S	S	*	.	H	α-helix	trans	-62.9	-39.5	179.2	-73.3	-165.6	-173.8	0	0	112.9	E130 L135 K136	E130-E132 PolarHBondContact O-N 3Å; E132-L135 PolarHBondContact O-N 3.39Å; E132-K136 WeakPolarHBondContact O-CB 3.46Å; E132-K136 WeakPolarHBondContact O-CD 3.32Å; E132-K136 WeakPolarHBondContact O-CG 3.37Å; E132-K136 PolarHBondContact O-N 3.24Å; E132-K136 IonicContact OE2-NZ 2.74Å; E132-K136 PolarHBondContact OE2-NZ 3.38Å; E132-K136 VanDerWaalsContact OE2-NZ 3.12Å
133	E	80	Confident	80.3	Confident	51 Å²	51	71 Å²	71	24%	0.238	36%	0.357	C	S	.	.	H	α-helix	trans	-70	-39.1	179.6	-64.3	-155.5	126.2	0	0	110.9	Y104 E130 V131 K136 E137 R237	Y104-E133 WeakPolarHBondContact CE1-OE2 3.33Å; E130-E133 PolarHBondContact O-N 2.97Å; V131-E133 VanDerWaalsContact C-N 3.34Å; V131-E133 PolarHBondContact O-N 2.86Å; E133-K136 PolarHBondContact O-N 3Å; E133-E137 PolarHBondContact O-N 3.17Å; E133-R237 IonicContact OE1-NH2 3.59Å; E133-R237 PolarHBondContact OE1-NH2 2.79Å
134	F	83.4	Confident	80.3	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.009	36%	0.355	C	S	.	.	H	α-helix	trans	-60.1	-46	173.1	-171.5	-87.9	0	0	0	112.2	K122 L124 E130 V131 E137 A138 F162 I164	K122-F134 HydrophobicContact CD-CE2 4.44Å; K122-F134 HydrophobicContact CG-CE2 4.14Å; L124-F134 HydrophobicContact CB-CD2 4.28Å; L124-F134 HydrophobicContact CB-CE2 4.45Å; L124-F134 HydrophobicContact CD1-CB 4.17Å; L124-F134 HydrophobicContact CD1-CD2 4.14Å; L124-F134 HydrophobicContact CD1-CG 4.39Å; E130-F134 PolarHBondContact O-N 3.07Å; V131-F134 PolarHBondContact O-N 3.49Å; F134-E137 PolarHBondContact O-N 3.02Å; F134-A138 PolarHBondContact O-N 2.92Å; F134-A138 VanDerWaalsContact O-N 3.1Å; F134-F162 HydrophobicContact CD1-CB 4.01Å; F134-F162 HydrophobicContact CE1-CB 3.55Å; F134-F162 HydrophobicContact CZ-CB 4.25Å; F134-F162 WeakPolarHBondContact CZ-O 3.41Å; F134-I164 HydrophobicContact CD1-CD1 4.12Å; F134-I164 HydrophobicContact CD1-CG1 4.44Å; F134-I164 HydrophobicContact CD2-CD1 4.23Å; F134-I164 HydrophobicContact CE1-CD1 3.79Å; F134-I164 HydrophobicContact CE1-CG1 3.67Å; F134-I164 HydrophobicContact CE2-CD1 3.92Å; F134-I164 HydrophobicContact CE2-CG1 4.3Å; F134-I164 HydrophobicContact CG-CD1 4.33Å; F134-I164 HydrophobicContact CZ-CB 4.19Å; F134-I164 HydrophobicContact CZ-CD1 3.69Å; F134-I164 HydrophobicContact CZ-CG1 3.6Å
135	L	85.7	Confident	80.8	Confident	68 Å²	68	74.6 Å²	74.6	36%	0.356	37%	0.371	S	S	.	.	H	α-helix	trans	-69	-34.3	177.4	-67	177.7	0	0	0	112.4	V131 E132 A138 A139 T157	V131-L135 HydrophobicContact CG1-CD1 3.92Å; V131-L135 HydrophobicContact CG1-CG 4.3Å; V131-L135 WeakPolarHBondContact O-CG 3.48Å; V131-L135 PolarHBondContact O-N 3.19Å; E132-L135 PolarHBondContact O-N 3.39Å; L135-A138 PolarHBondContact O-N 2.92Å; L135-A139 WeakPolarHBondContact O-CB 3.47Å; L135-A139 PolarHBondContact O-N 3.46Å; L135-T157 HydrophobicContact CD2-CG2 3.64Å
136	K	84.2	Confident	82	Confident	101 Å²	101	70.9 Å²	70.9	44%	0.439	36%	0.356	S	S	.	.	H	α-helix	trans	-63.1	-43	172.7	-77.7	165.1	-173.4	155.6	0	111.2	E132 E133 A139 V140	E132-K136 WeakPolarHBondContact O-CB 3.46Å; E132-K136 WeakPolarHBondContact O-CD 3.32Å; E132-K136 WeakPolarHBondContact O-CG 3.37Å; E132-K136 PolarHBondContact O-N 3.24Å; E132-K136 IonicContact OE2-NZ 2.74Å; E132-K136 PolarHBondContact OE2-NZ 3.38Å; E132-K136 VanDerWaalsContact OE2-NZ 3.12Å; E133-K136 PolarHBondContact O-N 3Å; K136-A139 PolarHBondContact O-N 2.96Å; K136-V140 WeakPolarHBondContact O-CG2 3.41Å; K136-V140 PolarHBondContact O-N 3.23Å
137	E	85.9	Confident	83.4	Confident	11 Å²	11	65.1 Å²	65.1	5%	0.051	33%	0.333	C	S	.	.	H	α-helix	trans	-59	-49	174.7	-177	178.2	174.9	0	0	111.1	K122 E133 F134 A139 V140 M141 I164 F233	K122-E137 IonicContact NZ-OE1 3.48Å; K122-E137 PolarHBondContact NZ-OE1 3.18Å; K122-E137 IonicContact NZ-OE2 3.53Å; K122-E137 PolarHBondContact NZ-OE2 3.44Å; E133-E137 PolarHBondContact O-N 3.17Å; F134-E137 PolarHBondContact O-N 3.02Å; E137-A139 VanDerWaalsContact C-N 3.29Å; E137-A139 PolarHBondContact O-N 3.3Å; E137-V140 PolarHBondContact O-N 2.96Å; E137-M141 HydrophobicContact CG-SD 4.49Å; E137-M141 WeakPolarHBondContact O-CG 3.49Å; E137-M141 PolarHBondContact O-N 3.08Å; E137-I164 HydrophobicContact CB-CD1 4.33Å; E137-I164 HydrophobicContact CG-CD1 4.26Å; E137-F233 HydrophobicContact CG-CB 4.38Å
138	A	87.2	Confident	85	Confident	5 Å²	5	57.7 Å²	57.7	4%	0.041	29%	0.293	C	S	.	.	H	α-helix	trans	-56.8	-42.3	175.8	0	0	0	0	0	112.4	F134 L135 M141 K142 V155 I164	F134-A138 PolarHBondContact O-N 2.92Å; F134-A138 VanDerWaalsContact O-N 3.1Å; L135-A138 PolarHBondContact O-N 2.92Å; A138-M141 PolarHBondContact O-N 2.96Å; A138-K142 WeakPolarHBondContact O-CG 3.41Å; A138-K142 PolarHBondContact O-N 3.22Å; A138-V155 HydrophobicContact CB-CG1 4.14Å; A138-I164 HydrophobicContact CB-CD1 3.93Å; A138-I164 HydrophobicContact CB-CG1 3.93Å
139	A	87.7	Confident	86.6	Confident	54 Å²	54	55.4 Å²	55.4	45%	0.446	28%	0.279	S	S	.	.	H	α-helix	trans	-64.4	-42	178	0	0	0	0	0	112.3	L135 K136 E137 K142	L135-A139 WeakPolarHBondContact O-CB 3.47Å; L135-A139 PolarHBondContact O-N 3.46Å; K136-A139 PolarHBondContact O-N 2.96Å; E137-A139 VanDerWaalsContact C-N 3.29Å; E137-A139 PolarHBondContact O-N 3.3Å; A139-K142 PolarHBondContact O-N 3.44Å
140	V	86.4	Confident	88.3	Confident	22 Å²	22	46.5 Å²	46.5	13%	0.133	24%	0.236	C	C	.	.	H	α-helix	trans	-61.3	-46	174.9	170	0	0	0	0	110.8	K136 E137 K142 E143 I144 F210 F233	K136-V140 WeakPolarHBondContact O-CG2 3.41Å; K136-V140 PolarHBondContact O-N 3.23Å; E137-V140 PolarHBondContact O-N 2.96Å; V140-K142 PolarHBondContact O-N 3.3Å; V140-E143 PolarHBondContact O-N 3.25Å; V140-E143 VanDerWaalsContact O-N 3.1Å; V140-I144 HydrophobicContact CG1-CD1 3.65Å; V140-I144 HydrophobicContact CG1-CG1 4.36Å; V140-I144 WeakPolarHBondContact O-CG1 3.32Å; V140-I144 PolarHBondContact O-N 3.03Å; V140-F210 HydrophobicContact CB-CE1 4.35Å; V140-F210 HydrophobicContact CG1-CD1 4.22Å; V140-F210 HydrophobicContact CG1-CE1 3.67Å; V140-F210 HydrophobicContact CG1-CZ 4.18Å; V140-F210 HydrophobicContact CG2-CE1 3.86Å; V140-F210 HydrophobicContact CG2-CZ 4.46Å; V140-F233 HydrophobicContact CG1-CB 4.49Å
141	M	89.4	Confident	89.3	Confident	9 Å²	9	43.4 Å²	43.4	4%	0.044	22%	0.221	C	C	.	.	H	α-helix	trans	-64.8	-23.8	-178.2	-66.3	-168.7	74	0	0	114	E137 A138 E143 V150 L152 I164 T166 F233	E137-M141 HydrophobicContact CG-SD 4.49Å; E137-M141 WeakPolarHBondContact O-CG 3.49Å; E137-M141 PolarHBondContact O-N 3.08Å; A138-M141 PolarHBondContact O-N 2.96Å; M141-E143 VanDerWaalsContact C-N 3.32Å; M141-V150 HydrophobicContact CE-CG1 4.38Å; M141-L152 HydrophobicContact CB-CB 4.07Å; M141-L152 HydrophobicContact CB-CD1 4.35Å; M141-L152 HydrophobicContact CB-CD2 4.26Å; M141-L152 HydrophobicContact CB-CG 4.47Å; M141-L152 HydrophobicContact CE-CB 4.46Å; M141-I164 HydrophobicContact SD-CG2 3.93Å; M141-T166 HydrophobicContact CE-CG2 3.45Å; M141-T166 VanDerWaalsContact CE-CG2 3.45Å; M141-T166 HydrophobicContact SD-CG2 4.21Å; M141-F233 HydrophobicContact CE-CD2 4.26Å; M141-F233 HydrophobicContact CE-CE2 4.4Å; M141-F233 HydrophobicContact CG-CD2 3.96Å; M141-F233 HydrophobicContact SD-CD2 4.31Å
142	K	90.3	Very high	90	Very high	56 Å²	56	40.9 Å²	40.9	24%	0.243	21%	0.206	C	C	.	.	H	α-helix	trans	-67.4	-31.5	174	-71.1	177.7	178.6	-170.3	0	113	D84 W86 A138 A139 V140 L152	D84-K142 IonicContact OD1-NZ 2.64Å; W86-K142 HydrophobicContact CD2-CG 4.09Å; W86-K142 HydrophobicContact CG-CD 4.12Å; W86-K142 HydrophobicContact CG-CG 4.08Å; W86-K142 HydrophobicContact CZ2-CB 4.31Å; W86-K142 HydrophobicContact CZ2-CG 4.35Å; A138-K142 WeakPolarHBondContact O-CG 3.41Å; A138-K142 PolarHBondContact O-N 3.22Å; A139-K142 PolarHBondContact O-N 3.44Å; V140-K142 PolarHBondContact O-N 3.3Å; K142-L152 HydrophobicContact CB-CD2 4.41Å; K142-L152 HydrophobicContact CG-CD2 3.53Å
143	E	87.4	Confident	90.6	Very high	132 Å²	132	35.3 Å²	35.3	62%	0.617	18%	0.18	S	C	*	.	H	α-helix	trans	-86.6	-22	-177.4	-63.1	-54.9	132.6	0	0	112.8	V140 M141 K145 Y204	V140-E143 PolarHBondContact O-N 3.25Å; V140-E143 VanDerWaalsContact O-N 3.1Å; M141-E143 VanDerWaalsContact C-N 3.32Å; E143-K145 PolarHBondContact O-N 3.5Å; E143-Y204 PolarHBondContact O-OH 3.2Å
144	I	89.5	Confident	91.3	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.026	17%	0.169	C	C	.	.			trans	-79.2	121	-177.6	-69.3	174.6	0	0	0	110.7	V140 L149 Q151 Y204 L205 F233	V140-I144 HydrophobicContact CG1-CD1 3.65Å; V140-I144 HydrophobicContact CG1-CG1 4.36Å; V140-I144 WeakPolarHBondContact O-CG1 3.32Å; V140-I144 PolarHBondContact O-N 3.03Å; I144-L149 HydrophobicContact CG2-CB 3.62Å; I144-L149 HydrophobicContact CG2-CD1 3.42Å; I144-L149 VanDerWaalsContact CG2-CD1 3.42Å; I144-L149 HydrophobicContact CG2-CG 4.09Å; I144-Q151 PolarHBondContact O-OE1 3.11Å; I144-Y204 HydrophobicContact CG2-CE1 4.35Å; I144-L205 HydrophobicContact CD1-CD2 4.21Å; I144-F233 HydrophobicContact CD1-CD1 3.7Å; I144-F233 HydrophobicContact CD1-CE1 3.61Å; I144-F233 HydrophobicContact CD1-CE2 4.41Å; I144-F233 HydrophobicContact CD1-CG 4.18Å; I144-F233 HydrophobicContact CD1-CZ 3.99Å
145	K	94.1	Very high	92	Very high	107 Å²	107	32.8 Å²	32.8	47%	0.465	17%	0.169	S	C	.	.			trans	-138.3	92.3	177.8	-61.3	-180	-173.1	173.9	0	109.9	Y77 E143 Y204	Y77-K145 HydrophobicContact CD1-CB 3.98Å; Y77-K145 HydrophobicContact CD1-CG 4.29Å; Y77-K145 HydrophobicContact CD2-CB 4.02Å; Y77-K145 HydrophobicContact CD2-CD 4.43Å; Y77-K145 HydrophobicContact CD2-CG 4.37Å; Y77-K145 HydrophobicContact CE1-CB 4.09Å; Y77-K145 HydrophobicContact CE2-CB 4.12Å; Y77-K145 HydrophobicContact CG-CB 3.93Å; Y77-K145 HydrophobicContact CG-CD 4.36Å; Y77-K145 HydrophobicContact CG-CG 4.01Å; E143-K145 PolarHBondContact O-N 3.5Å; K145-Y204 PolarHBondContact N-OH 3.44Å; K145-Y204 VanDerWaalsContact O-CE2 3.27Å; K145-Y204 WeakPolarHBondContact O-CE2 3.15Å; K145-Y204 PolarHBondContact O-OH 3.04Å
146	H	96.5	Very high	92.4	Very high	21 Å²	21	29.8 Å²	29.8	10%	0.097	15%	0.153	C	C	.	.			trans	-151.5	140.3	-179.3	-167.9	-96.1	0	0	0	111	Y77 N148 L149 Q151 S200 Y204	Y77-H146 VanDerWaalsContact CE1-N 3.33Å; Y77-H146 WeakPolarHBondContact OH-CA 3.42Å; H146-N148 PolarHBondContact ND1-N 3.31Å; H146-N148 VanDerWaalsContact ND1-N 3.13Å; H146-N148 PolarHBondContact O-N 3Å; H146-N148 VanDerWaalsContact O-N 3.14Å; H146-L149 HydrophobicContact CB-CB 4.14Å; H146-L149 HydrophobicContact CB-CD1 3.68Å; H146-L149 HydrophobicContact CB-CG 4.01Å; H146-L149 PolarHBondContact O-N 3.03Å; H146-Q151 PolarHBondContact O-NE2 3.48Å; H146-S200 PolarHBondContact CE1-O 3.11Å; H146-S200 PolarHBondContact CE1-OG 3Å; H146-S200 VanDerWaalsContact CE1-OG 3.27Å; H146-S200 PolarHBondContact NE2-OG 3.42Å; H146-Y204 HydrophobicContact CB-CD1 4.05Å; H146-Y204 HydrophobicContact CB-CD2 4.16Å; H146-Y204 HydrophobicContact CB-CE1 4.34Å; H146-Y204 HydrophobicContact CB-CE2 4.42Å; H146-Y204 HydrophobicContact CB-CG 3.95Å; H146-Y204 AromaticContact CD2-CD2 3.65Å; H146-Y204 AromaticContact CD2-CG 3.68Å; H146-Y204 AromaticContact CG-CG 3.93Å
147	P	97.2	Very high	92.8	Very high	49 Å²	49	27 Å²	27	32%	0.318	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-26.9	-178.6	23.7	-35.8	0	0	0	114	Y77 K229	Y77-P147 WeakPolarHBondContact OH-CD 3.4Å; P147-K229 WeakPolarHBondContact O-CE 3.47Å; P147-K229 PolarHBondContact O-NZ 3.45Å
148	N	98.1	Very high	93.1	Very high	15 Å²	15	36.1 Å²	36.1	8%	0.08	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	18.8	-177.9	-57.1	104.9	0	0	0	114.1	H146 Q197 A201 V228 K229 V230	H146-N148 PolarHBondContact ND1-N 3.31Å; H146-N148 VanDerWaalsContact ND1-N 3.13Å; H146-N148 PolarHBondContact O-N 3Å; H146-N148 VanDerWaalsContact O-N 3.14Å; N148-Q197 HydrophobicContact CB-CB 4.48Å; N148-Q197 WeakPolarHBondContact CB-O 3.36Å; N148-Q197 WeakPolarHBondContact ND2-CB 3.47Å; N148-Q197 WeakPolarHBondContact ND2-CG 3.42Å; N148-Q197 PolarHBondContact ND2-OE1 3.14Å; N148-A201 HydrophobicContact CB-CB 3.84Å; N148-A201 VanDerWaalsContact O-CB 3.27Å; N148-A201 WeakPolarHBondContact O-CB 3.49Å; N148-V228 PolarHBondContact ND2-O 3.32Å; N148-K229 CarbonylContact O-C 3.47Å; N148-K229 VanDerWaalsContact O-CA 3.26Å; N148-K229 WeakPolarHBondContact O-CA 3.45Å; N148-V230 PolarHBondContact O-N 3.18Å
149	L	96.8	Very high	93.2	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-116.8	140.4	167.4	-68.3	166.8	0	0	0	108.3	I144 H146 Q151 A201 Y204 L205 V230 F233	I144-L149 HydrophobicContact CG2-CB 3.62Å; I144-L149 HydrophobicContact CG2-CD1 3.42Å; I144-L149 VanDerWaalsContact CG2-CD1 3.42Å; I144-L149 HydrophobicContact CG2-CG 4.09Å; H146-L149 HydrophobicContact CB-CB 4.14Å; H146-L149 HydrophobicContact CB-CD1 3.68Å; H146-L149 HydrophobicContact CB-CG 4.01Å; H146-L149 PolarHBondContact O-N 3.03Å; L149-Q151 PolarHBondContact O-N 2.8Å; L149-Q151 PolarHBondContact O-NE2 3.4Å; L149-A201 HydrophobicContact CD2-CB 3.95Å; L149-A201 HydrophobicContact CG-CB 4.02Å; L149-Y204 HydrophobicContact CD1-CD1 3.5Å; L149-Y204 VanDerWaalsContact CD1-CD1 3.5Å; L149-Y204 HydrophobicContact CD1-CE1 3.97Å; L149-Y204 HydrophobicContact CD1-CG 4.38Å; L149-L205 HydrophobicContact CD1-CD2 3.76Å; L149-L205 HydrophobicContact CD1-CG 4.05Å; L149-L205 HydrophobicContact CD2-CD1 4.14Å; L149-L205 HydrophobicContact CD2-CD2 4.47Å; L149-L205 HydrophobicContact CD2-CG 4.33Å; L149-V230 HydrophobicContact CD2-CB 3.89Å; L149-V230 HydrophobicContact CD2-CG1 4.45Å; L149-F233 HydrophobicContact CB-CZ 4.12Å; L149-F233 HydrophobicContact CD2-CE1 3.78Å; L149-F233 HydrophobicContact CD2-CZ 3.54Å; L149-F233 HydrophobicContact CG-CZ 4.35Å
150	V	95.8	Very high	93.3	Very high	9 Å²	9	44 Å²	44	6%	0.055	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-60.5	128.5	178.5	171.6	0	0	0	0	110.2	M141 T166 E167 L221 K229 V230 A231	M141-V150 HydrophobicContact CE-CG1 4.38Å; V150-T166 HydrophobicContact CG1-CG2 4.14Å; V150-E167 HydrophobicContact CG1-CG 4.34Å; V150-L221 HydrophobicContact CG2-CD1 4Å; V150-K229 HydrophobicContact CG2-CB 3.86Å; V150-V230 PolarHBondContact N-O 3.41Å; V150-A231 HydrophobicContact CB-CB 4.44Å; V150-A231 HydrophobicContact CG2-CB 3.62Å
151	Q	95.1	Very high	93.5	Very high	5 Å²	5	45.3 Å²	45.3	2%	0.023	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-92.3	133.9	-173	-63.7	-53.8	-47.9	0	0	113.2	T75 Y77 I144 H146 L149 T166 E167	T75-Q151 HydrophobicContact CG2-CG 3.66Å; Y77-Q151 HydrophobicContact CD1-CG 4.14Å; Y77-Q151 HydrophobicContact CE1-CG 4.32Å; I144-Q151 PolarHBondContact O-OE1 3.11Å; H146-Q151 PolarHBondContact O-NE2 3.48Å; L149-Q151 PolarHBondContact O-N 2.8Å; L149-Q151 PolarHBondContact O-NE2 3.4Å; Q151-T166 VanDerWaalsContact O-CA 3.29Å; Q151-T166 WeakPolarHBondContact O-CA 3.36Å; Q151-T166 WeakPolarHBondContact O-CB 3.29Å; Q151-E167 VanDerWaalsContact CB-OE1 3.27Å; Q151-E167 WeakPolarHBondContact CB-OE1 3.23Å; Q151-E167 WeakPolarHBondContact CG-OE1 3.37Å; Q151-E167 PolarHBondContact N-OE1 3.48Å; Q151-E167 PolarHBondContact O-N 3.14Å; Q151-E167 VanDerWaalsContact O-N 3.13Å
152	L	95.4	Very high	93.6	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	130.4	168.2	-170.5	67.8	0	0	0	109.9	W86 M141 K142 G154 V155 I164	W86-L152 HydrophobicContact CD2-CD2 4.05Å; W86-L152 HydrophobicContact CE3-CD2 3.75Å; W86-L152 HydrophobicContact CE3-CG 4.04Å; W86-L152 HydrophobicContact CZ3-CB 4.16Å; W86-L152 HydrophobicContact CZ3-CD2 4.04Å; W86-L152 HydrophobicContact CZ3-CG 4.12Å; W86-L152 WeakPolarHBondContact CZ3-O 3.24Å; M141-L152 HydrophobicContact CB-CB 4.07Å; M141-L152 HydrophobicContact CB-CD1 4.35Å; M141-L152 HydrophobicContact CB-CD2 4.26Å; M141-L152 HydrophobicContact CB-CG 4.47Å; M141-L152 HydrophobicContact CE-CB 4.46Å; K142-L152 HydrophobicContact CB-CD2 4.41Å; K142-L152 HydrophobicContact CG-CD2 3.53Å; L152-G154 WeakPolarHBondContact CD1-O 3.31Å; L152-V155 HydrophobicContact CD1-CG1 4.04Å; L152-V155 HydrophobicContact CD2-CG1 4.3Å; L152-I164 HydrophobicContact CD1-CG2 3.8Å
153	L	96	Very high	93.7	Very high	18 Å²	18	44.9 Å²	44.9	9%	0.094	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-29.4	171.6	-59.6	-178.8	0	0	0	111.4	V79 W112 L117 V119 I165 E167	V79-L153 HydrophobicContact CG1-CB 4.42Å; V79-L153 HydrophobicContact CG1-CD2 4.12Å; W112-L153 HydrophobicContact CZ3-CB 4.05Å; L117-L153 HydrophobicContact CD2-CD1 4Å; V119-L153 HydrophobicContact CG1-CD1 3.69Å; L153-I165 HydrophobicContact CB-CG2 4.33Å; L153-I165 PolarHBondContact N-O 3.36Å; L153-E167 HydrophobicContact CD1-CB 4.48Å
154	G	96.1	Very high	94.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.3	-168.6	166.4	0	0	0	0	0	112.8	W86 L152 I165	W86-G154 CarbonylContact O-C 3.49Å; W86-G154 WeakPolarHBondContact O-CA 3.45Å; L152-G154 WeakPolarHBondContact CD1-O 3.31Å; G154-I165 PolarHBondContact N-O 3.36Å; G154-I165 WeakPolarHBondContact O-CB 3.41Å; G154-I165 WeakPolarHBondContact O-CD1 3.3Å; G154-I165 PolarHBondContact O-N 3.03Å
155	V	96.2	Very high	94.4	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	156.9	-173.3	-61.2	0	0	0	0	111.4	W86 E87 M88 A138 L152 T157 Y163	W86-V155 HydrophobicContact CB-CG2 4.02Å; W86-V155 PolarHBondContact O-N 3.42Å; E87-V155 WeakPolarHBondContact CA-O 3.48Å; E87-V155 HydrophobicContact CG-CG2 4.41Å; E87-V155 WeakPolarHBondContact OE1-CG2 3.48Å; M88-V155 PolarHBondContact N-O 3.34Å; A138-V155 HydrophobicContact CB-CG1 4.14Å; L152-V155 HydrophobicContact CD1-CG1 4.04Å; L152-V155 HydrophobicContact CD2-CG1 4.3Å; V155-T157 HydrophobicContact CB-CG2 4.05Å; V155-T157 HydrophobicContact CG2-CG2 4.23Å; V155-Y163 CarbonylContact C-O 3.51Å; V155-Y163 VanDerWaalsContact CA-O 3.28Å; V155-Y163 WeakPolarHBondContact CA-O 3.3Å
156	C	95.6	Very high	94.4	Very high	5 Å²	5	34.2 Å²	34.2	3%	0.034	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	94.5	165.3	-58.8	0	0	0	0	108.2	M88 F162 Y163	M88-C156 VanDerWaalsContact CG-SG 3.6Å; M88-C156 PolarHBondContact O-SG 3.27Å; C156-F162 VanDerWaalsContact O-CA 3.29Å; C156-F162 WeakPolarHBondContact O-CA 3.39Å; C156-Y163 HydrophobicContact CB-CD2 4.5Å; C156-Y163 HydrophobicContact CB-CG 4.44Å; C156-Y163 PolarHBondContact N-O 3.47Å; C156-Y163 PolarHBondContact O-N 3.32Å
157	T	92.9	Very high	94.4	Very high	43 Å²	43	35.2 Å²	35.2	26%	0.264	18%	0.178	S	C	.	.			trans	-119.3	4.6	-176.4	68.6	0	0	0	0	114.5	E87 L135 V155 E159 F162	E87-T157 WeakPolarHBondContact OE1-CB 3.38Å; E87-T157 PolarHBondContact OE1-N 3.27Å; E87-T157 PolarHBondContact OE1-OG1 3.39Å; E87-T157 PolarHBondContact OE2-N 3.02Å; L135-T157 HydrophobicContact CD2-CG2 3.64Å; V155-T157 HydrophobicContact CB-CG2 4.05Å; V155-T157 HydrophobicContact CG2-CG2 4.23Å; T157-E159 PolarHBondContact O-N 3.49Å; T157-F162 VanDerWaalsContact O-CE1 3.28Å; T157-F162 WeakPolarHBondContact O-CE1 3.42Å
158	R	91.3	Very high	94.4	Very high	202 Å²	202	35.5 Å²	35.5	76%	0.762	17%	0.174	S	C	*	.	S	Bend	trans	-65.6	-37.3	179.3	-67.7	179.1	-175.8	-174.7	1.6	113.9	E87	E87-R158 IonicContact OE2-NE 3.82Å
159	E	90.4	Very high	94.3	Very high	128 Å²	128	35.4 Å²	35.4	60%	0.598	17%	0.174	S	C	*	.	S	Bend	trans	-153.7	155.7	-178.8	61.2	-171	179.7	0	0	109.5	R90 T157 F162	R90-E159 PolarHBondContact NH2-O 3.44Å; T157-E159 PolarHBondContact O-N 3.49Å; E159-F162 VanDerWaalsContact C-CE1 3.41Å; E159-F162 WeakPolarHBondContact O-CD1 3.27Å; E159-F162 WeakPolarHBondContact O-CE1 3.24Å
160	P	88.8	Confident	94.3	Very high	97 Å²	97	38.6 Å²	38.6	63%	0.63	19%	0.193	S	C	*	.	S	Bend	trans	-64.6	157.8	174.4	-23.9	35.4	0	0	0	113.7	R90 F162	R90-P160 PolarHBondContact NH1-O 3.4Å; R90-P160 PolarHBondContact NH2-O 2.64Å; P160-F162 HydrophobicContact CG-CE1 4.28Å; P160-F162 HydrophobicContact CG-CZ 4.3Å
161	P	90.1	Very high	94.3	Very high	49 Å²	49	43.7 Å²	43.7	32%	0.318	21%	0.212	S	C	.	.	S	Bend	cis	-71.9	133.9	-11.8	28.8	-37	0	0	0	113.1	R90 Y163	R90-P161 PolarHBondContact NE-O 3.25Å; R90-P161 PolarHBondContact NH2-O 3.49Å; P161-Y163 HydrophobicContact CB-CE1 4.24Å; P161-Y163 HydrophobicContact CG-CE1 4.05Å
162	F	91.4	Very high	94.3	Very high	31 Å²	31	45.1 Å²	45.1	14%	0.136	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-74.2	136.9	-177.4	-60.4	-35.9	0	0	0	112.9	T123 V131 F134 C156 T157 E159 P160	T123-F162 WeakPolarHBondContact CA-O 3.46Å; V131-F162 HydrophobicContact CG1-CD2 4.16Å; V131-F162 HydrophobicContact CG1-CE2 3.61Å; V131-F162 HydrophobicContact CG2-CE2 4.39Å; F134-F162 HydrophobicContact CD1-CB 4.01Å; F134-F162 HydrophobicContact CE1-CB 3.55Å; F134-F162 HydrophobicContact CZ-CB 4.25Å; F134-F162 WeakPolarHBondContact CZ-O 3.41Å; C156-F162 VanDerWaalsContact O-CA 3.29Å; C156-F162 WeakPolarHBondContact O-CA 3.39Å; T157-F162 VanDerWaalsContact O-CE1 3.28Å; T157-F162 WeakPolarHBondContact O-CE1 3.42Å; E159-F162 VanDerWaalsContact C-CE1 3.41Å; E159-F162 WeakPolarHBondContact O-CD1 3.27Å; E159-F162 WeakPolarHBondContact O-CE1 3.24Å; P160-F162 HydrophobicContact CG-CE1 4.28Å; P160-F162 HydrophobicContact CG-CZ 4.3Å
163	Y	94.1	Very high	94.4	Very high	24 Å²	24	46.8 Å²	46.8	9%	0.094	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	139.9	179	-65.9	-11.5	0	0	0	112.8	R90 I93 M95 V121 K122 T123 V155 C156 P161	R90-Y163 HydrophobicContact CG-CD2 4.03Å; R90-Y163 HydrophobicContact CG-CE2 3.55Å; I93-Y163 HydrophobicContact CG2-CE2 4.48Å; M95-Y163 HydrophobicContact SD-CE2 4.09Å; V121-Y163 HydrophobicContact CG1-CD1 4Å; V121-Y163 HydrophobicContact CG1-CD2 3.75Å; V121-Y163 HydrophobicContact CG1-CE1 4.47Å; V121-Y163 HydrophobicContact CG1-CE2 4.19Å; V121-Y163 HydrophobicContact CG1-CG 3.66Å; K122-Y163 WeakPolarHBondContact O-CA 3.5Å; T123-Y163 WeakPolarHBondContact OG1-CE1 3.47Å; V155-Y163 CarbonylContact C-O 3.51Å; V155-Y163 VanDerWaalsContact CA-O 3.28Å; V155-Y163 WeakPolarHBondContact CA-O 3.3Å; C156-Y163 HydrophobicContact CB-CD2 4.5Å; C156-Y163 HydrophobicContact CB-CG 4.44Å; C156-Y163 PolarHBondContact N-O 3.47Å; C156-Y163 PolarHBondContact O-N 3.32Å; P161-Y163 HydrophobicContact CB-CE1 4.24Å; P161-Y163 HydrophobicContact CG-CE1 4.05Å
164	I	94.1	Very high	94.5	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.2	160.5	-68.9	165.4	0	0	0	106.9	V121 K122 F134 E137 A138 M141 L152 T166	V121-I164 WeakPolarHBondContact CA-O 3.37Å; K122-I164 HydrophobicContact CB-CB 4.3Å; K122-I164 PolarHBondContact N-O 2.68Å; K122-I164 PolarHBondContact O-N 3.07Å; F134-I164 HydrophobicContact CD1-CD1 4.12Å; F134-I164 HydrophobicContact CD1-CG1 4.44Å; F134-I164 HydrophobicContact CD2-CD1 4.23Å; F134-I164 HydrophobicContact CE1-CD1 3.79Å; F134-I164 HydrophobicContact CE1-CG1 3.67Å; F134-I164 HydrophobicContact CE2-CD1 3.92Å; F134-I164 HydrophobicContact CE2-CG1 4.3Å; F134-I164 HydrophobicContact CG-CD1 4.33Å; F134-I164 HydrophobicContact CZ-CB 4.19Å; F134-I164 HydrophobicContact CZ-CD1 3.69Å; F134-I164 HydrophobicContact CZ-CG1 3.6Å; E137-I164 HydrophobicContact CB-CD1 4.33Å; E137-I164 HydrophobicContact CG-CD1 4.26Å; A138-I164 HydrophobicContact CB-CD1 3.93Å; A138-I164 HydrophobicContact CB-CG1 3.93Å; M141-I164 HydrophobicContact SD-CG2 3.93Å; L152-I164 HydrophobicContact CD1-CG2 3.8Å; I164-T166 HydrophobicContact CG2-CG2 4Å
165	I	95.8	Very high	94.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.8	-176.5	-57.4	84.5	0	0	0	108.7	M88 I93 V119 V121 L153 G154	M88-I165 HydrophobicContact CE-CB 3.89Å; M88-I165 HydrophobicContact CE-CD1 3.89Å; M88-I165 HydrophobicContact CE-CG1 4.01Å; M88-I165 HydrophobicContact CE-CG2 4.25Å; M88-I165 HydrophobicContact CG-CD1 4.31Å; M88-I165 HydrophobicContact SD-CB 4.41Å; M88-I165 HydrophobicContact SD-CD1 3.8Å; M88-I165 HydrophobicContact SD-CG1 3.93Å; I93-I165 HydrophobicContact CD1-CG1 4.37Å; V119-I165 HydrophobicContact CB-CG2 3.77Å; V119-I165 HydrophobicContact CG1-CG2 4.02Å; V119-I165 HydrophobicContact CG2-CG2 3.87Å; V121-I165 HydrophobicContact CG1-CG1 4.45Å; V121-I165 HydrophobicContact CG2-CG1 4.39Å; L153-I165 HydrophobicContact CB-CG2 4.33Å; L153-I165 PolarHBondContact N-O 3.36Å; G154-I165 PolarHBondContact N-O 3.36Å; G154-I165 WeakPolarHBondContact O-CB 3.41Å; G154-I165 WeakPolarHBondContact O-CD1 3.3Å; G154-I165 PolarHBondContact O-N 3.03Å
166	T	95.8	Very high	94.7	Very high	19 Å²	19	50 Å²	50	12%	0.117	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	166.8	-176.8	60.3	0	0	0	0	111.4	V119 A120 M141 V150 Q151 I164	V119-T166 WeakPolarHBondContact CB-O 3.41Å; A120-T166 PolarHBondContact N-O 3.2Å; A120-T166 PolarHBondContact O-N 3.22Å; A120-T166 PolarHBondContact O-OG1 3.24Å; M141-T166 HydrophobicContact CE-CG2 3.45Å; M141-T166 VanDerWaalsContact CE-CG2 3.45Å; M141-T166 HydrophobicContact SD-CG2 4.21Å; V150-T166 HydrophobicContact CG1-CG2 4.14Å; Q151-T166 VanDerWaalsContact O-CA 3.29Å; Q151-T166 WeakPolarHBondContact O-CA 3.36Å; Q151-T166 WeakPolarHBondContact O-CB 3.29Å; I164-T166 HydrophobicContact CG2-CG2 4Å
167	E	95.2	Very high	94.8	Very high	42 Å²	42	51.5 Å²	51.5	20%	0.196	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	143.1	170.1	70.1	-170.9	129.9	0	0	111.4	V150 Q151 L153 M169 K229	V150-E167 HydrophobicContact CG1-CG 4.34Å; Q151-E167 VanDerWaalsContact CB-OE1 3.27Å; Q151-E167 WeakPolarHBondContact CB-OE1 3.23Å; Q151-E167 WeakPolarHBondContact CG-OE1 3.37Å; Q151-E167 PolarHBondContact N-OE1 3.48Å; Q151-E167 PolarHBondContact O-N 3.14Å; Q151-E167 VanDerWaalsContact O-N 3.13Å; L153-E167 HydrophobicContact CD1-CB 4.48Å; E167-M169 HydrophobicContact CG-SD 4.21Å; E167-K229 VanDerWaalsContact OE1-CD 3.23Å; E167-K229 WeakPolarHBondContact OE1-CD 3.33Å; E167-K229 WeakPolarHBondContact OE1-CE 3.49Å; E167-K229 IonicContact OE1-NZ 3.55Å; E167-K229 PolarHBondContact OE1-NZ 3.16Å; E167-K229 WeakPolarHBondContact OE2-CE 3.47Å; E167-K229 IonicContact OE2-NZ 2.78Å; E167-K229 PolarHBondContact OE2-NZ 3.35Å
168	F	96.8	Very high	95.1	Very high	55 Å²	55	49.5 Å²	49.5	24%	0.241	25%	0.247	C	C	.	.			trans	-87.7	128.8	176.7	-179.3	-106.5	0	0	0	110.9	L99 E109 T118 A120 T170	L99-F168 HydrophobicContact CD1-CD2 4.05Å; L99-F168 HydrophobicContact CD1-CE2 3.65Å; L99-F168 HydrophobicContact CD2-CE2 3.87Å; L99-F168 HydrophobicContact CD2-CZ 4.44Å; L99-F168 HydrophobicContact CG-CE2 4.42Å; E109-F168 HydrophobicContact CG-CD2 4.46Å; E109-F168 HydrophobicContact CG-CE2 4.2Å; T118-F168 HydrophobicContact CG2-CB 4.01Å; T118-F168 HydrophobicContact CG2-CD1 3.69Å; T118-F168 HydrophobicContact CG2-CD2 4.34Å; T118-F168 HydrophobicContact CG2-CE1 4.22Å; T118-F168 HydrophobicContact CG2-CG 3.75Å; T118-F168 WeakPolarHBondContact O-CB 3.17Å; A120-F168 HydrophobicContact CB-CD2 4.46Å; F168-T170 HydrophobicContact CD1-CG2 4.03Å; F168-T170 HydrophobicContact CE1-CG2 4.07Å
169	M	97	Very high	95.4	Very high	13 Å²	13	45.9 Å²	45.9	6%	0.064	23%	0.233	C	C	.	.			trans	-100.1	108.1	179.5	-61.4	-62.2	-68.2	0	0	109.5	E167 Y171 G172 L221 V222 K229	E167-M169 HydrophobicContact CG-SD 4.21Å; M169-Y171 VanDerWaalsContact C-N 3.3Å; M169-Y171 PolarHBondContact O-N 3.12Å; M169-G172 PolarHBondContact O-N 3.46Å; M169-L221 HydrophobicContact CB-CB 3.61Å; M169-L221 HydrophobicContact CB-CD1 4.04Å; M169-L221 HydrophobicContact CB-CG 4.41Å; M169-L221 HydrophobicContact CE-CB 4.23Å; M169-L221 WeakPolarHBondContact CE-O 3.49Å; M169-L221 HydrophobicContact CG-CB 3.57Å; M169-L221 HydrophobicContact CG-CD1 3.76Å; M169-L221 HydrophobicContact CG-CG 4.33Å; M169-V222 CarbonylContact C-O 3.55Å; M169-K229 HydrophobicContact CE-CB 3.96Å; M169-K229 HydrophobicContact CE-CD 4.02Å; M169-K229 HydrophobicContact CE-CG 3.69Å; M169-K229 HydrophobicContact SD-CD 3.91Å; M169-K229 HydrophobicContact SD-CG 4.24Å
170	T	96.1	Very high	95.8	Very high	67 Å²	67	47.5 Å²	47.5	41%	0.411	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-25.5	-161.3	44.2	0	0	0	0	115.5	F168 V222 E224	F168-T170 HydrophobicContact CD1-CG2 4.03Å; F168-T170 HydrophobicContact CE1-CG2 4.07Å; T170-V222 PolarHBondContact N-O 2.89Å; T170-E224 WeakPolarHBondContact CB-OE1 3.25Å; T170-E224 PolarHBondContact OG1-OE1 3.5Å
171	Y	96.6	Very high	96.2	Very high	116 Å²	116	44 Å²	44	46%	0.455	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	15.4	-176.1	-60.1	-86.3	0	0	0	113.4	M169 Y177 V222 G223 E224	M169-Y171 VanDerWaalsContact C-N 3.3Å; M169-Y171 PolarHBondContact O-N 3.12Å; Y171-Y177 HydrophobicContact CD1-CE2 4.33Å; Y171-Y177 HydrophobicContact CG-CE2 4.34Å; Y171-V222 PolarHBondContact N-O 3.34Å; Y171-G223 WeakPolarHBondContact CD2-O 3.31Å; Y171-E224 WeakPolarHBondContact CE2-OE1 3.47Å; Y171-E224 WeakPolarHBondContact CE2-OE2 3.5Å; Y171-E224 PolarHBondContact OH-OE2 2.76Å
172	G	95.3	Very high	96.6	Very high	34 Å²	34	46.3 Å²	46.3	35%	0.351	23%	0.228	S	C	.	.			trans	69.4	-148.6	175.8	0	0	0	0	0	113	M169 L221 V222	M169-G172 PolarHBondContact O-N 3.46Å; G172-L221 CarbonylContact O-C 3.58Å; G172-L221 VanDerWaalsContact O-CA 3.29Å; G172-L221 WeakPolarHBondContact O-CA 3.4Å; G172-V222 PolarHBondContact O-N 3.34Å
173	N	96.4	Very high	96.9	Very high	36 Å²	36	51.4 Å²	51.4	19%	0.193	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-86.2	154.5	-177.3	74.5	77.8	0	0	0	112.8	L175 D176 Y177 R218 C220 L221	N173-L175 VanDerWaalsContact C-N 3.31Å; N173-L175 PolarHBondContact O-N 3.24Å; N173-L175 VanDerWaalsContact OD1-CB 3.3Å; N173-L175 WeakPolarHBondContact OD1-CB 3.35Å; N173-L175 PolarHBondContact OD1-N 2.67Å; N173-D176 PolarHBondContact ND2-OD2 3.01Å; N173-D176 PolarHBondContact OD1-N 3.25Å; N173-Y177 WeakPolarHBondContact O-CB 3.37Å; N173-Y177 PolarHBondContact O-N 3.03Å; N173-R218 WeakPolarHBondContact CB-O 3.43Å; N173-C220 CarbonylContact C-O 3.49Å; N173-C220 WeakPolarHBondContact CA-O 3.49Å; N173-L221 HydrophobicContact CB-CD2 4.05Å
174	L	98.5	Very high	97	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66.4	-31.4	-175.5	179.1	63.9	0	0	0	112.3	Y177 L178 M194 I198 A217 C220 V222 I283	L174-Y177 HydrophobicContact CD1-CD1 4.37Å; L174-L178 HydrophobicContact CD1-CD1 4.11Å; L174-L178 HydrophobicContact CD1-CD2 4.35Å; L174-L178 HydrophobicContact CD1-CG 3.88Å; L174-L178 HydrophobicContact CD2-CD1 4.5Å; L174-L178 HydrophobicContact CG-CD1 3.85Å; L174-L178 HydrophobicContact CG-CG 4.13Å; L174-L178 WeakPolarHBondContact O-CB 3.43Å; L174-L178 WeakPolarHBondContact O-CD1 3.44Å; L174-L178 WeakPolarHBondContact O-CG 3.33Å; L174-L178 PolarHBondContact O-N 3.1Å; L174-M194 HydrophobicContact CD1-CE 4.07Å; L174-M194 HydrophobicContact CD1-SD 3.57Å; L174-M194 VanDerWaalsContact CD1-SD 3.57Å; L174-I198 HydrophobicContact CD2-CD1 3.77Å; L174-A217 WeakPolarHBondContact CB-O 3.37Å; L174-A217 PolarHBondContact N-O 2.98Å; L174-C220 HydrophobicContact CB-CB 3.8Å; L174-C220 HydrophobicContact CD2-CB 3.97Å; L174-C220 PolarHBondContact N-O 3.05Å; L174-V222 HydrophobicContact CB-CG2 3.99Å; L174-V222 HydrophobicContact CD1-CG2 3.84Å; L174-I283 HydrophobicContact CD2-CD1 4.17Å; L174-I283 HydrophobicContact CD2-CG1 4.12Å
175	L	98.3	Very high	97.1	Very high	21 Å²	21	63.6 Å²	63.6	11%	0.11	30%	0.304	C	S	.	.	H	α-helix	trans	-63.4	-50	179.9	179.3	62.6	0	0	0	111.4	N173 L178 R179 A217 R218	N173-L175 VanDerWaalsContact C-N 3.31Å; N173-L175 PolarHBondContact O-N 3.24Å; N173-L175 VanDerWaalsContact OD1-CB 3.3Å; N173-L175 WeakPolarHBondContact OD1-CB 3.35Å; N173-L175 PolarHBondContact OD1-N 2.67Å; L175-L178 PolarHBondContact O-N 2.89Å; L175-R179 WeakPolarHBondContact O-CG 3.49Å; L175-R179 PolarHBondContact O-N 2.98Å; L175-A217 HydrophobicContact CB-CB 3.91Å; L175-A217 HydrophobicContact CD1-CB 4.37Å; L175-A217 PolarHBondContact N-O 2.85Å; L175-R218 HydrophobicContact CD2-CB 4.3Å
176	D	97.8	Very high	97.2	Very high	65 Å²	65	63.6 Å²	63.6	35%	0.348	30%	0.304	S	S	.	.	H	α-helix	trans	-69.7	-41.2	179	-63	-27.1	0	0	0	110.4	N173 L178 R179 E180	N173-D176 PolarHBondContact ND2-OD2 3.01Å; N173-D176 PolarHBondContact OD1-N 3.25Å; D176-L178 VanDerWaalsContact C-N 3.34Å; D176-L178 PolarHBondContact O-N 2.95Å; D176-R179 PolarHBondContact O-N 2.95Å; D176-R179 VanDerWaalsContact O-N 3.1Å; D176-E180 WeakPolarHBondContact O-CB 3.4Å; D176-E180 WeakPolarHBondContact O-CG 3.47Å; D176-E180 PolarHBondContact O-N 3.1Å
177	Y	98.6	Very high	97.3	Very high	38 Å²	38	65.8 Å²	65.8	15%	0.149	32%	0.315	C	S	.	.	H	α-helix	trans	-54.4	-47.7	174.2	-176.2	-96	0	0	0	112.3	Y171 N173 L174 R179 E180 C181 V186 M194 V222 H226	Y171-Y177 HydrophobicContact CD1-CE2 4.33Å; Y171-Y177 HydrophobicContact CG-CE2 4.34Å; N173-Y177 WeakPolarHBondContact O-CB 3.37Å; N173-Y177 PolarHBondContact O-N 3.03Å; L174-Y177 HydrophobicContact CD1-CD1 4.37Å; Y177-R179 VanDerWaalsContact C-N 3.31Å; Y177-R179 PolarHBondContact O-N 3.19Å; Y177-E180 PolarHBondContact O-N 3.18Å; Y177-C181 HydrophobicContact CE1-CB 4.33Å; Y177-C181 WeakPolarHBondContact O-CB 3.39Å; Y177-C181 PolarHBondContact O-N 3.41Å; Y177-V186 HydrophobicContact CE1-CG2 4.07Å; Y177-M194 HydrophobicContact CE1-SD 4.4Å; Y177-V222 HydrophobicContact CD1-CG1 4.33Å; Y177-V222 HydrophobicContact CD1-CG2 4.21Å; Y177-V222 HydrophobicContact CD2-CB 4.45Å; Y177-V222 HydrophobicContact CD2-CG1 4.12Å; Y177-V222 HydrophobicContact CE1-CG1 4.36Å; Y177-V222 HydrophobicContact CE2-CG1 4.15Å; Y177-V222 HydrophobicContact CG-CB 4.36Å; Y177-V222 HydrophobicContact CG-CG1 4.22Å; Y177-V222 HydrophobicContact CG-CG2 4.02Å; Y177-H226 PolarHBondContact OH-CD2 3.29Å; Y177-H226 PolarHBondContact OH-NE2 3.11Å
178	L	98.7	Very high	97.4	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-62.4	-37.1	178.6	-75.8	169	0	0	0	112.7	L174 L175 D176 C181 L191 M194 I283 Y286	L174-L178 HydrophobicContact CD1-CD1 4.11Å; L174-L178 HydrophobicContact CD1-CD2 4.35Å; L174-L178 HydrophobicContact CD1-CG 3.88Å; L174-L178 HydrophobicContact CD2-CD1 4.5Å; L174-L178 HydrophobicContact CG-CD1 3.85Å; L174-L178 HydrophobicContact CG-CG 4.13Å; L174-L178 WeakPolarHBondContact O-CB 3.43Å; L174-L178 WeakPolarHBondContact O-CD1 3.44Å; L174-L178 WeakPolarHBondContact O-CG 3.33Å; L174-L178 PolarHBondContact O-N 3.1Å; L175-L178 PolarHBondContact O-N 2.89Å; D176-L178 VanDerWaalsContact C-N 3.34Å; D176-L178 PolarHBondContact O-N 2.95Å; L178-C181 PolarHBondContact O-SG 3.19Å; L178-L191 HydrophobicContact CD2-CD2 3.61Å; L178-M194 HydrophobicContact CD2-CE 3.92Å; L178-I283 HydrophobicContact CD1-CG1 4.21Å; L178-Y286 HydrophobicContact CD2-CD1 4.39Å
179	R	98.5	Very high	97.4	Very high	127 Å²	127	69.9 Å²	69.9	48%	0.479	35%	0.354	S	S	.	.	H	α-helix	trans	-71.8	-34.4	-179.4	-73.2	170.8	173.7	169.5	-0.1	112.8	L175 D176 Y177 G287	L175-R179 WeakPolarHBondContact O-CG 3.49Å; L175-R179 PolarHBondContact O-N 2.98Å; D176-R179 PolarHBondContact O-N 2.95Å; D176-R179 VanDerWaalsContact O-N 3.1Å; Y177-R179 VanDerWaalsContact C-N 3.31Å; Y177-R179 PolarHBondContact O-N 3.19Å; R179-G287 PolarHBondContact NE-O 3.43Å; R179-G287 PolarHBondContact NH2-O 3.49Å
180	E	98.2	Very high	97.5	Very high	162 Å²	162	70.2 Å²	70.2	76%	0.757	36%	0.357	S	S	*	.	H	α-helix	trans	-99.5	-16.9	-172.3	-64.4	177.3	-174.5	0	0	113.5	D176 Y177	D176-E180 WeakPolarHBondContact O-CB 3.4Å; D176-E180 WeakPolarHBondContact O-CG 3.47Å; D176-E180 PolarHBondContact O-N 3.1Å; Y177-E180 PolarHBondContact O-N 3.18Å
181	C	97.9	Very high	97.6	Very high	23 Å²	23	67.8 Å²	67.8	16%	0.155	34%	0.342	C	S	.	.	S	Bend	trans	-65.1	156.7	-175	70.8	0	0	0	0	114.5	Y177 L178 R183 V186	Y177-C181 HydrophobicContact CE1-CB 4.33Å; Y177-C181 WeakPolarHBondContact O-CB 3.39Å; Y177-C181 PolarHBondContact O-N 3.41Å; L178-C181 PolarHBondContact O-SG 3.19Å; C181-R183 PolarHBondContact O-N 3.38Å; C181-V186 HydrophobicContact CB-CB 4.25Å; C181-V186 HydrophobicContact CB-CG2 3.67Å
182	N	98.1	Very high	97.7	Very high	97 Å²	97	67.4 Å²	67.4	52%	0.519	35%	0.347	S	S	.	.			trans	-74	107.6	165.4	-178.2	-10.9	0	0	0	110.2	Q184 E185 V186	N182-Q184 PolarHBondContact O-N 2.89Å; N182-Q184 VanDerWaalsContact O-N 3.1Å; N182-Q184 WeakPolarHBondContact OD1-CB 3.44Å; N182-Q184 PolarHBondContact OD1-N 3.49Å; N182-E185 HydrophobicContact CB-CB 4.32Å; N182-E185 PolarHBondContact O-N 3.37Å; N182-V186 PolarHBondContact O-N 3.47Å
183	R	97.3	Very high	97.9	Very high	138 Å²	138	71 Å²	71	52%	0.521	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-17.1	-177.8	-57.6	-168.3	-177.9	-170.7	-2	115	C181 V186 Y286	C181-R183 PolarHBondContact O-N 3.38Å; R183-V186 CarbonylContact O-C 3.59Å; R183-Y286 HydrophobicContact CB-CE1 4.07Å; R183-Y286 HydrophobicContact CG-CD1 3.87Å; R183-Y286 HydrophobicContact CG-CE1 3.69Å; R183-Y286 HydrophobicContact CG-CG 4.4Å
184	Q	96	Very high	98	Very high	163 Å²	163	69.3 Å²	69.3	76%	0.762	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-37.1	173.1	-62.2	-60.5	-34.3	0	0	111.6	N182	N182-Q184 PolarHBondContact O-N 2.89Å; N182-Q184 VanDerWaalsContact O-N 3.1Å; N182-Q184 WeakPolarHBondContact OD1-CB 3.44Å; N182-Q184 PolarHBondContact OD1-N 3.49Å
185	E	96.4	Very high	98	Very high	119 Å²	119	69.8 Å²	69.8	56%	0.556	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-51.3	173.7	-178.5	176.2	179.6	0	0	110.4	N182 N187 V190	N182-E185 HydrophobicContact CB-CB 4.32Å; N182-E185 PolarHBondContact O-N 3.37Å; E185-N187 PolarHBondContact O-N 2.92Å; E185-V190 WeakPolarHBondContact O-CG2 3.37Å
186	V	98.2	Very high	98	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	36%	0.363	C	S	.	.	S	Bend	trans	-85.9	66.2	176.6	-170.5	0	0	0	0	109.4	Y177 C181 N182 R183 V190 L191 M194 Y286	Y177-V186 HydrophobicContact CE1-CG2 4.07Å; C181-V186 HydrophobicContact CB-CB 4.25Å; C181-V186 HydrophobicContact CB-CG2 3.67Å; N182-V186 PolarHBondContact O-N 3.47Å; R183-V186 CarbonylContact O-C 3.59Å; V186-V190 HydrophobicContact CG1-CB 4.19Å; V186-V190 HydrophobicContact CG1-CG1 3.9Å; V186-L191 HydrophobicContact CG1-CD2 3.91Å; V186-M194 HydrophobicContact CG1-CE 3.92Å; V186-Y286 HydrophobicContact CG1-CE1 4.39Å; V186-Y286 VanDerWaalsContact O-CE1 3.3Å; V186-Y286 WeakPolarHBondContact O-CE1 3.45Å; V186-Y286 PolarHBondContact O-OH 3.22Å
187	N	97.6	Very high	98.1	Very high	66 Å²	66	70 Å²	70	35%	0.353	35%	0.349	S	S	.	.			trans	-81	-179.6	176.9	64.3	49.2	0	0	0	111.9	E185 V189 V190 L191	E185-N187 PolarHBondContact O-N 2.92Å; N187-V189 PolarHBondContact O-N 3.33Å; N187-V189 VanDerWaalsContact O-N 3.07Å; N187-V189 WeakPolarHBondContact OD1-CB 3.39Å; N187-V189 PolarHBondContact OD1-N 3.39Å; N187-V190 WeakPolarHBondContact O-CA 3.02Å; N187-V190 WeakPolarHBondContact O-CB 3.45Å; N187-V190 PolarHBondContact O-N 2.82Å; N187-L191 PolarHBondContact O-N 3.21Å
188	A	97.6	Very high	98.1	Very high	71 Å²	71	68.2 Å²	68.2	59%	0.587	34%	0.342	S	S	*	.	H	α-helix	trans	-54.5	-30	-177.9	0	0	0	0	0	114.8	L192	A188-L192 WeakPolarHBondContact O-CB 3.4Å; A188-L192 PolarHBondContact O-N 3.02Å
189	V	97.6	Very high	98.1	Very high	111 Å²	111	68.8 Å²	68.8	67%	0.673	35%	0.346	S	S	*	.	H	α-helix	trans	-69.2	-39.3	176.3	-179.6	0	0	0	0	110.6	N187 Y193	N187-V189 PolarHBondContact O-N 3.33Å; N187-V189 VanDerWaalsContact O-N 3.07Å; N187-V189 WeakPolarHBondContact OD1-CB 3.39Å; N187-V189 PolarHBondContact OD1-N 3.39Å; V189-Y193 WeakPolarHBondContact O-CB 3.45Å; V189-Y193 PolarHBondContact O-N 3.47Å
190	V	98.4	Very high	98.1	Very high	20 Å²	20	64.5 Å²	64.5	12%	0.121	34%	0.335	C	S	.	.	H	α-helix	trans	-69.7	-41.4	176.1	-176.2	0	0	0	0	110.6	E185 V186 N187 L192 Y193 M194 H226	E185-V190 WeakPolarHBondContact O-CG2 3.37Å; V186-V190 HydrophobicContact CG1-CB 4.19Å; V186-V190 HydrophobicContact CG1-CG1 3.9Å; N187-V190 WeakPolarHBondContact O-CA 3.02Å; N187-V190 WeakPolarHBondContact O-CB 3.45Å; N187-V190 PolarHBondContact O-N 2.82Å; V190-L192 PolarHBondContact O-N 2.8Å; V190-Y193 WeakPolarHBondContact O-CB 3.38Å; V190-Y193 PolarHBondContact O-N 3.04Å; V190-M194 HydrophobicContact CG1-CE 4.24Å; V190-M194 WeakPolarHBondContact O-CG 3.2Å; V190-M194 PolarHBondContact O-N 3.09Å; V190-H226 HydrophobicContact CG1-CB 3.93Å
191	L	98.8	Very high	98.1	Very high	17 Å²	17	56.8 Å²	56.8	9%	0.089	30%	0.299	C	S	.	.	H	α-helix	trans	-58	-47.4	174.2	-63	-175.7	0	0	0	111.8	L178 V186 N187 Y193 M194 A195 I283 Y286	L178-L191 HydrophobicContact CD2-CD2 3.61Å; V186-L191 HydrophobicContact CG1-CD2 3.91Å; N187-L191 PolarHBondContact O-N 3.21Å; L191-Y193 VanDerWaalsContact C-N 3.34Å; L191-Y193 PolarHBondContact O-N 2.91Å; L191-M194 HydrophobicContact CD2-CE 3.75Å; L191-M194 PolarHBondContact O-N 3.08Å; L191-A195 WeakPolarHBondContact O-CB 3.5Å; L191-A195 PolarHBondContact O-N 3.41Å; L191-I283 HydrophobicContact CB-CG2 3.84Å; L191-I283 HydrophobicContact CD2-CG2 3.99Å; L191-I283 HydrophobicContact CG-CG2 4.36Å; L191-Y286 HydrophobicContact CD1-CE1 4.3Å; L191-Y286 HydrophobicContact CD1-CE2 3.9Å; L191-Y286 HydrophobicContact CD2-CD1 4.49Å; L191-Y286 HydrophobicContact CD2-CE1 4.05Å
192	L	98.4	Very high	98.1	Very high	107 Å²	107	55.7 Å²	55.7	56%	0.56	29%	0.292	S	S	*	.	H	α-helix	trans	-61.2	-43.7	175.2	-179.2	62.2	0	0	0	111.3	A188 V190 M194 A195 T196	A188-L192 WeakPolarHBondContact O-CB 3.4Å; A188-L192 PolarHBondContact O-N 3.02Å; V190-L192 PolarHBondContact O-N 2.8Å; L192-M194 VanDerWaalsContact C-N 3.31Å; L192-M194 PolarHBondContact O-N 3.19Å; L192-A195 PolarHBondContact O-N 2.88Å; L192-T196 PolarHBondContact O-N 3.4Å; L192-T196 PolarHBondContact O-OG1 3.16Å
193	Y	98.5	Very high	98.1	Very high	111 Å²	111	53.6 Å²	53.6	44%	0.435	28%	0.279	S	S	.	.	H	α-helix	trans	-59	-40.4	177.1	179.9	-118.7	0	0	0	112.7	V189 V190 L191 Q197 H226	V189-Y193 WeakPolarHBondContact O-CB 3.45Å; V189-Y193 PolarHBondContact O-N 3.47Å; V190-Y193 WeakPolarHBondContact O-CB 3.38Å; V190-Y193 PolarHBondContact O-N 3.04Å; L191-Y193 VanDerWaalsContact C-N 3.34Å; L191-Y193 PolarHBondContact O-N 2.91Å; Y193-Q197 VanDerWaalsContact CD1-NE2 3.3Å; Y193-Q197 HydrophobicContact CE2-CG 4.48Å; Y193-Q197 VanDerWaalsContact O-CG 3.29Å; Y193-Q197 WeakPolarHBondContact O-CG 3.27Å; Y193-Q197 PolarHBondContact O-N 3.49Å; Y193-Q197 PolarHBondContact O-NE2 3.31Å; Y193-H226 HydrophobicContact CD1-CB 4.23Å; Y193-H226 HydrophobicContact CE1-CB 4.35Å
194	M	98.9	Very high	98.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69	-44.2	175.4	-67.7	-171	-65.2	0	0	111.7	L174 Y177 L178 V186 V190 L191 L192 T196 Q197 I198 V228	L174-M194 HydrophobicContact CD1-CE 4.07Å; L174-M194 HydrophobicContact CD1-SD 3.57Å; L174-M194 VanDerWaalsContact CD1-SD 3.57Å; Y177-M194 HydrophobicContact CE1-SD 4.4Å; L178-M194 HydrophobicContact CD2-CE 3.92Å; V186-M194 HydrophobicContact CG1-CE 3.92Å; V190-M194 HydrophobicContact CG1-CE 4.24Å; V190-M194 WeakPolarHBondContact O-CG 3.2Å; V190-M194 PolarHBondContact O-N 3.09Å; L191-M194 HydrophobicContact CD2-CE 3.75Å; L191-M194 PolarHBondContact O-N 3.08Å; L192-M194 VanDerWaalsContact C-N 3.31Å; L192-M194 PolarHBondContact O-N 3.19Å; M194-T196 PolarHBondContact O-N 2.83Å; M194-Q197 WeakPolarHBondContact O-CB 3.42Å; M194-Q197 PolarHBondContact O-N 3.22Å; M194-I198 WeakPolarHBondContact O-CG1 3.38Å; M194-I198 PolarHBondContact O-N 3.47Å; M194-V228 HydrophobicContact CB-CG2 3.82Å; M194-V228 HydrophobicContact CG-CG2 3.56Å; M194-V228 HydrophobicContact SD-CG2 3.9Å
195	A	98.8	Very high	98.1	Very high	10 Å²	10	41.2 Å²	41.2	8%	0.083	23%	0.226	C	C	.	.	H	α-helix	trans	-59.7	-43.8	177.5	0	0	0	0	0	112.6	L191 L192 Q197 I198 S199 L280 I283	L191-A195 WeakPolarHBondContact O-CB 3.5Å; L191-A195 PolarHBondContact O-N 3.41Å; L192-A195 PolarHBondContact O-N 2.88Å; A195-Q197 VanDerWaalsContact C-N 3.33Å; A195-Q197 PolarHBondContact O-N 3.16Å; A195-I198 PolarHBondContact O-N 2.77Å; A195-S199 PolarHBondContact O-N 3.48Å; A195-L280 HydrophobicContact CB-CD2 3.64Å; A195-I283 HydrophobicContact CB-CD1 4.12Å
196	T	98.8	Very high	98	Very high	76 Å²	76	37.2 Å²	37.2	47%	0.466	21%	0.207	S	C	.	.	H	α-helix	trans	-63.4	-36.8	177.3	-58.5	0	0	0	0	112.6	L192 M194 I198 S199 S200	L192-T196 PolarHBondContact O-N 3.4Å; L192-T196 PolarHBondContact O-OG1 3.16Å; M194-T196 PolarHBondContact O-N 2.83Å; T196-I198 VanDerWaalsContact C-N 3.32Å; T196-S199 PolarHBondContact O-N 2.74Å; T196-S199 PolarHBondContact O-OG 2.96Å; T196-S199 VanDerWaalsContact O-OG 3.08Å; T196-S200 WeakPolarHBondContact O-CB 3.32Å; T196-S200 PolarHBondContact O-N 3.25Å
197	Q	98.8	Very high	97.9	Very high	13 Å²	13	43.7 Å²	43.7	6%	0.061	24%	0.235	C	C	.	.	H	α-helix	trans	-64.5	-39.3	175.7	-76.7	175	88.6	0	0	111.9	N148 Y193 M194 A195 A201 H226 V228	N148-Q197 HydrophobicContact CB-CB 4.48Å; N148-Q197 WeakPolarHBondContact CB-O 3.36Å; N148-Q197 WeakPolarHBondContact ND2-CB 3.47Å; N148-Q197 WeakPolarHBondContact ND2-CG 3.42Å; N148-Q197 PolarHBondContact ND2-OE1 3.14Å; Y193-Q197 VanDerWaalsContact CD1-NE2 3.3Å; Y193-Q197 HydrophobicContact CE2-CG 4.48Å; Y193-Q197 VanDerWaalsContact O-CG 3.29Å; Y193-Q197 WeakPolarHBondContact O-CG 3.27Å; Y193-Q197 PolarHBondContact O-N 3.49Å; Y193-Q197 PolarHBondContact O-NE2 3.31Å; M194-Q197 WeakPolarHBondContact O-CB 3.42Å; M194-Q197 PolarHBondContact O-N 3.22Å; A195-Q197 VanDerWaalsContact C-N 3.33Å; A195-Q197 PolarHBondContact O-N 3.16Å; Q197-A201 PolarHBondContact O-N 3.17Å; Q197-A201 VanDerWaalsContact O-N 3.13Å; Q197-H226 PolarHBondContact NE2-O 2.93Å; Q197-V228 HydrophobicContact CB-CB 4.42Å
198	I	98.8	Very high	97.6	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-69.8	-44.5	177.8	-62.5	164.9	0	0	0	110.4	L174 M194 A195 T196 S200 A201 M202 L215 C220 V228 V230 F276 L279 I283	L174-I198 HydrophobicContact CD2-CD1 3.77Å; M194-I198 WeakPolarHBondContact O-CG1 3.38Å; M194-I198 PolarHBondContact O-N 3.47Å; A195-I198 PolarHBondContact O-N 2.77Å; T196-I198 VanDerWaalsContact C-N 3.32Å; I198-S200 VanDerWaalsContact C-N 3.31Å; I198-S200 PolarHBondContact O-N 2.81Å; I198-A201 WeakPolarHBondContact O-CB 3.27Å; I198-A201 PolarHBondContact O-N 3.29Å; I198-M202 WeakPolarHBondContact O-CG 3.35Å; I198-M202 PolarHBondContact O-N 3.49Å; I198-L215 HydrophobicContact CG2-CD1 4.3Å; I198-C220 HydrophobicContact CD1-CB 4.37Å; I198-V228 HydrophobicContact CD1-CG1 3.96Å; I198-V228 HydrophobicContact CG1-CG1 3.71Å; I198-V230 HydrophobicContact CB-CG2 4.46Å; I198-V230 HydrophobicContact CG1-CG2 4.43Å; I198-V230 HydrophobicContact CG2-CG2 3.92Å; I198-F276 HydrophobicContact CB-CE2 4.23Å; I198-F276 HydrophobicContact CG2-CD2 4.01Å; I198-F276 HydrophobicContact CG2-CE2 3.86Å; I198-L279 HydrophobicContact CD1-CD1 4.34Å; I198-L279 HydrophobicContact CD1-CD2 3.81Å; I198-L279 HydrophobicContact CG2-CD1 4.39Å; I198-L279 HydrophobicContact CG2-CD2 4.07Å; I198-I283 HydrophobicContact CD1-CD1 3.95Å
199	S	98.7	Very high	97.3	Very high	13 Å²	13	47.3 Å²	47.3	9%	0.091	24%	0.24	C	C	.	.	H	α-helix	trans	-61.7	-40.4	177.4	68.2	0	0	0	0	111.7	A195 T196 A201 M202 E203	A195-S199 PolarHBondContact O-N 3.48Å; T196-S199 PolarHBondContact O-N 2.74Å; T196-S199 PolarHBondContact O-OG 2.96Å; T196-S199 VanDerWaalsContact O-OG 3.08Å; S199-A201 PolarHBondContact O-N 3.39Å; S199-M202 CarbonylContact O-C 3.37Å; S199-M202 PolarHBondContact O-N 3.26Å; S199-M202 VanDerWaalsContact O-N 3.11Å; S199-E203 WeakPolarHBondContact O-CB 3.46Å; S199-E203 PolarHBondContact O-N 3.16Å
200	S	98.6	Very high	97	Very high	36 Å²	36	42.9 Å²	42.9	25%	0.252	21%	0.212	S	C	.	.	H	α-helix	trans	-60.7	-40.5	174.4	178.8	0	0	0	0	112.9	H146 T196 I198 M202 Y204	H146-S200 PolarHBondContact CE1-O 3.11Å; H146-S200 PolarHBondContact CE1-OG 3Å; H146-S200 VanDerWaalsContact CE1-OG 3.27Å; H146-S200 PolarHBondContact NE2-OG 3.42Å; T196-S200 WeakPolarHBondContact O-CB 3.32Å; T196-S200 PolarHBondContact O-N 3.25Å; I198-S200 VanDerWaalsContact C-N 3.31Å; I198-S200 PolarHBondContact O-N 2.81Å; S200-M202 VanDerWaalsContact C-N 3.33Å; S200-M202 PolarHBondContact O-N 3.38Å; S200-Y204 PolarHBondContact O-N 3.18Å; S200-Y204 VanDerWaalsContact O-N 3.14Å
201	A	98.2	Very high	96.7	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-42.1	173	0	0	0	0	0	112.2	N148 L149 Q197 I198 S199 Y204 L205 V230	N148-A201 HydrophobicContact CB-CB 3.84Å; N148-A201 VanDerWaalsContact O-CB 3.27Å; N148-A201 WeakPolarHBondContact O-CB 3.49Å; L149-A201 HydrophobicContact CD2-CB 3.95Å; L149-A201 HydrophobicContact CG-CB 4.02Å; Q197-A201 PolarHBondContact O-N 3.17Å; Q197-A201 VanDerWaalsContact O-N 3.13Å; I198-A201 WeakPolarHBondContact O-CB 3.27Å; I198-A201 PolarHBondContact O-N 3.29Å; S199-A201 PolarHBondContact O-N 3.39Å; A201-Y204 WeakPolarHBondContact O-CB 3.47Å; A201-Y204 PolarHBondContact O-N 2.95Å; A201-L205 PolarHBondContact O-N 3.17Å; A201-L205 VanDerWaalsContact O-N 3.17Å; A201-V230 HydrophobicContact CB-CB 4.42Å; A201-V230 HydrophobicContact CB-CG2 3.87Å
202	M	98.4	Very high	96.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-74.6	-34	-179.1	-64.2	-52.9	-57	0	0	113	I198 S199 S200 Y204 L205 E206 H212 L215 D272 F337	I198-M202 WeakPolarHBondContact O-CG 3.35Å; I198-M202 PolarHBondContact O-N 3.49Å; S199-M202 CarbonylContact O-C 3.37Å; S199-M202 PolarHBondContact O-N 3.26Å; S199-M202 VanDerWaalsContact O-N 3.11Å; S200-M202 VanDerWaalsContact C-N 3.33Å; S200-M202 PolarHBondContact O-N 3.38Å; M202-Y204 VanDerWaalsContact C-N 3.27Å; M202-Y204 PolarHBondContact O-N 3.07Å; M202-L205 HydrophobicContact CE-CD1 4.13Å; M202-L205 PolarHBondContact O-N 3.46Å; M202-L205 HydrophobicContact SD-CD1 3.93Å; M202-E206 WeakPolarHBondContact O-CB 3.33Å; M202-E206 PolarHBondContact O-N 3.19Å; M202-H212 HydrophobicContact CE-CB 4.01Å; M202-L215 HydrophobicContact CE-CD2 4.09Å; M202-L215 HydrophobicContact CG-CD2 3.9Å; M202-L215 HydrophobicContact SD-CD1 3.96Å; M202-L215 HydrophobicContact SD-CD2 3.92Å; M202-D272 HydrophobicContact CE-CB 3.9Å; M202-F337 HydrophobicContact CB-CB 4.33Å; M202-F337 HydrophobicContact CB-CD1 3.34Å; M202-F337 HydrophobicContact CB-CD2 3.73Å; M202-F337 HydrophobicContact CB-CE1 3.33Å; M202-F337 HydrophobicContact CB-CE2 3.72Å; M202-F337 HydrophobicContact CB-CG 3.53Å; M202-F337 HydrophobicContact CB-CZ 3.52Å; M202-F337 HydrophobicContact CE-CE2 3.81Å; M202-F337 HydrophobicContact CE-CZ 3.85Å; M202-F337 HydrophobicContact CG-CD1 4.24Å; M202-F337 HydrophobicContact CG-CE1 3.75Å; M202-F337 HydrophobicContact CG-CE2 4.36Å; M202-F337 HydrophobicContact CG-CZ 3.81Å
203	E	98.3	Very high	96.1	Very high	54 Å²	54	37.6 Å²	37.6	25%	0.252	18%	0.181	S	C	.	.	H	α-helix	trans	-59.5	-41.4	170.4	-174.8	-163.7	-174.4	0	0	110.6	S199 E206 K207 F337 A338	S199-E203 WeakPolarHBondContact O-CB 3.46Å; S199-E203 PolarHBondContact O-N 3.16Å; E203-E206 PolarHBondContact O-N 2.72Å; E203-K207 VanDerWaalsContact CD-NZ 3.27Å; E203-K207 HydrophobicContact CG-CD 4.45Å; E203-K207 WeakPolarHBondContact O-CG 3.27Å; E203-K207 PolarHBondContact O-N 3.39Å; E203-K207 VanDerWaalsContact OE1-CE 3.25Å; E203-K207 WeakPolarHBondContact OE1-CE 3.34Å; E203-K207 IonicContact OE1-NZ 2.76Å; E203-K207 PolarHBondContact OE1-NZ 2.99Å; E203-K207 IonicContact OE2-NZ 3.73Å; E203-F337 HydrophobicContact CB-CB 4.05Å; E203-A338 HydrophobicContact CG-CB 4.05Å
204	Y	96.9	Very high	95.8	Very high	39 Å²	39	33.2 Å²	33.2	15%	0.153	17%	0.165	C	C	.	.	H	α-helix	trans	-61.6	-45.8	174.3	175.6	-87.8	0	0	0	112.1	E143 I144 K145 H146 L149 S200 A201 M202 K207 K208	E143-Y204 PolarHBondContact O-OH 3.2Å; I144-Y204 HydrophobicContact CG2-CE1 4.35Å; K145-Y204 PolarHBondContact N-OH 3.44Å; K145-Y204 VanDerWaalsContact O-CE2 3.27Å; K145-Y204 WeakPolarHBondContact O-CE2 3.15Å; K145-Y204 PolarHBondContact O-OH 3.04Å; H146-Y204 HydrophobicContact CB-CD1 4.05Å; H146-Y204 HydrophobicContact CB-CD2 4.16Å; H146-Y204 HydrophobicContact CB-CE1 4.34Å; H146-Y204 HydrophobicContact CB-CE2 4.42Å; H146-Y204 HydrophobicContact CB-CG 3.95Å; H146-Y204 AromaticContact CD2-CD2 3.65Å; H146-Y204 AromaticContact CD2-CG 3.68Å; H146-Y204 AromaticContact CG-CG 3.93Å; L149-Y204 HydrophobicContact CD1-CD1 3.5Å; L149-Y204 VanDerWaalsContact CD1-CD1 3.5Å; L149-Y204 HydrophobicContact CD1-CE1 3.97Å; L149-Y204 HydrophobicContact CD1-CG 4.38Å; S200-Y204 PolarHBondContact O-N 3.18Å; S200-Y204 VanDerWaalsContact O-N 3.14Å; A201-Y204 WeakPolarHBondContact O-CB 3.47Å; A201-Y204 PolarHBondContact O-N 2.95Å; M202-Y204 VanDerWaalsContact C-N 3.27Å; M202-Y204 PolarHBondContact O-N 3.07Å; Y204-K207 PolarHBondContact O-N 2.9Å; Y204-K208 HydrophobicContact CD1-CG 4.28Å; Y204-K208 HydrophobicContact CE1-CG 3.86Å; Y204-K208 HydrophobicContact CE2-CG 4.32Å; Y204-K208 WeakPolarHBondContact O-CB 3.41Å; Y204-K208 VanDerWaalsContact O-CG 3.32Å; Y204-K208 WeakPolarHBondContact O-CG 3.48Å; Y204-K208 PolarHBondContact O-N 2.86Å; Y204-K208 VanDerWaalsContact O-N 3.09Å
205	L	94.6	Very high	95.8	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-41.8	178	-67	-179.1	0	0	0	111.6	I144 L149 A201 M202 K207 K208 N209 F210 F233	I144-L205 HydrophobicContact CD1-CD2 4.21Å; L149-L205 HydrophobicContact CD1-CD2 3.76Å; L149-L205 HydrophobicContact CD1-CG 4.05Å; L149-L205 HydrophobicContact CD2-CD1 4.14Å; L149-L205 HydrophobicContact CD2-CD2 4.47Å; L149-L205 HydrophobicContact CD2-CG 4.33Å; A201-L205 PolarHBondContact O-N 3.17Å; A201-L205 VanDerWaalsContact O-N 3.17Å; M202-L205 HydrophobicContact CE-CD1 4.13Å; M202-L205 PolarHBondContact O-N 3.46Å; M202-L205 HydrophobicContact SD-CD1 3.93Å; L205-K207 PolarHBondContact O-N 3.18Å; L205-K208 CarbonylContact O-C 3.58Å; L205-K208 WeakPolarHBondContact O-CA 3.33Å; L205-K208 PolarHBondContact O-N 3.13Å; L205-K208 VanDerWaalsContact O-N 3.08Å; L205-N209 PolarHBondContact O-N 2.87Å; L205-N209 VanDerWaalsContact O-N 3.08Å; L205-F210 HydrophobicContact CB-CB 4.12Å; L205-F210 HydrophobicContact CD2-CB 3.98Å; L205-F210 PolarHBondContact O-N 3.08Å; L205-F233 HydrophobicContact CD1-CE1 4.44Å
206	E	95.4	Very high	95.7	Very high	35 Å²	35	32.8 Å²	32.8	16%	0.164	16%	0.161	C	C	.	.	H	α-helix	trans	-55.1	-52.1	174	178.3	171.5	-113	0	0	111	M202 E203 K208 N209 I269 S336 F337 A338	M202-E206 WeakPolarHBondContact O-CB 3.33Å; M202-E206 PolarHBondContact O-N 3.19Å; E203-E206 PolarHBondContact O-N 2.72Å; E206-K208 PolarHBondContact O-N 3.14Å; E206-N209 PolarHBondContact O-N 3.13Å; E206-I269 HydrophobicContact CB-CD1 3.91Å; E206-I269 HydrophobicContact CB-CG1 3.83Å; E206-I269 HydrophobicContact CG-CG1 3.88Å; E206-S336 WeakPolarHBondContact OE1-CB 3.34Å; E206-F337 HydrophobicContact CB-CD2 4.47Å; E206-F337 PolarHBondContact OE1-N 3.3Å; E206-F337 PolarHBondContact OE2-N 3.44Å; E206-A338 PolarHBondContact OE2-N 2.8Å
207	K	95.3	Very high	95.7	Very high	137 Å²	137	29.1 Å²	29.1	60%	0.596	14%	0.139	S	C	*	.	H	α-helix	trans	-62.3	-24.7	177.6	-72	173.4	-175.2	168.1	0	113.7	E203 Y204 L205	E203-K207 VanDerWaalsContact CD-NZ 3.27Å; E203-K207 HydrophobicContact CG-CD 4.45Å; E203-K207 WeakPolarHBondContact O-CG 3.27Å; E203-K207 PolarHBondContact O-N 3.39Å; E203-K207 VanDerWaalsContact OE1-CE 3.25Å; E203-K207 WeakPolarHBondContact OE1-CE 3.34Å; E203-K207 IonicContact OE1-NZ 2.76Å; E203-K207 PolarHBondContact OE1-NZ 2.99Å; E203-K207 IonicContact OE2-NZ 3.73Å; Y204-K207 PolarHBondContact O-N 2.9Å; L205-K207 PolarHBondContact O-N 3.18Å
208	K	91.9	Very high	95.5	Very high	105 Å²	105	31.9 Å²	31.9	46%	0.457	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	5.3	177.3	-68.4	-69.2	-172.1	174.3	0	113.1	Y204 L205 E206 F210 L238	Y204-K208 HydrophobicContact CD1-CG 4.28Å; Y204-K208 HydrophobicContact CE1-CG 3.86Å; Y204-K208 HydrophobicContact CE2-CG 4.32Å; Y204-K208 WeakPolarHBondContact O-CB 3.41Å; Y204-K208 VanDerWaalsContact O-CG 3.32Å; Y204-K208 WeakPolarHBondContact O-CG 3.48Å; Y204-K208 PolarHBondContact O-N 2.86Å; Y204-K208 VanDerWaalsContact O-N 3.09Å; L205-K208 CarbonylContact O-C 3.58Å; L205-K208 WeakPolarHBondContact O-CA 3.33Å; L205-K208 PolarHBondContact O-N 3.13Å; L205-K208 VanDerWaalsContact O-N 3.08Å; E206-K208 PolarHBondContact O-N 3.14Å; K208-F210 VanDerWaalsContact C-N 3.25Å; K208-F210 HydrophobicContact CB-CD2 3.72Å; K208-F210 HydrophobicContact CB-CE2 4.3Å; K208-F210 WeakPolarHBondContact O-CD2 3.13Å; K208-F210 PolarHBondContact O-N 3.08Å; K208-L238 WeakPolarHBondContact O-CD1 3.45Å
209	N	90.3	Very high	95.4	Very high	107 Å²	107	32.8 Å²	32.8	57%	0.572	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	57	36.3	-176.6	-60.7	-45.6	0	0	0	113.2	L205 E206 L238 M239	L205-N209 PolarHBondContact O-N 2.87Å; L205-N209 VanDerWaalsContact O-N 3.08Å; E206-N209 PolarHBondContact O-N 3.13Å; N209-L238 HydrophobicContact CB-CD1 4.35Å; N209-M239 WeakPolarHBondContact O-CB 3.05Å; N209-M239 PolarHBondContact O-N 2.91Å
210	F	91.3	Very high	95.3	Very high	19 Å²	19	32.1 Å²	32.1	8%	0.083	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	141.9	173.3	-83.3	-82.6	0	0	0	111.3	V140 L205 K208 L238	V140-F210 HydrophobicContact CB-CE1 4.35Å; V140-F210 HydrophobicContact CG1-CD1 4.22Å; V140-F210 HydrophobicContact CG1-CE1 3.67Å; V140-F210 HydrophobicContact CG1-CZ 4.18Å; V140-F210 HydrophobicContact CG2-CE1 3.86Å; V140-F210 HydrophobicContact CG2-CZ 4.46Å; L205-F210 HydrophobicContact CB-CB 4.12Å; L205-F210 HydrophobicContact CD2-CB 3.98Å; L205-F210 PolarHBondContact O-N 3.08Å; K208-F210 VanDerWaalsContact C-N 3.25Å; K208-F210 HydrophobicContact CB-CD2 3.72Å; K208-F210 HydrophobicContact CB-CE2 4.3Å; K208-F210 WeakPolarHBondContact O-CD2 3.13Å; K208-F210 PolarHBondContact O-N 3.08Å; F210-L238 HydrophobicContact CD1-CB 4.33Å; F210-L238 HydrophobicContact CD2-CD1 4.14Å; F210-L238 HydrophobicContact CE1-CB 3.8Å; F210-L238 HydrophobicContact CE1-CD1 4.34Å; F210-L238 HydrophobicContact CE2-CD1 3.81Å; F210-L238 HydrophobicContact CZ-CB 4.03Å; F210-L238 HydrophobicContact CZ-CD1 3.93Å
211	I	92.5	Very high	95.3	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	139.9	166.4	59.7	169.4	0	0	0	110	R213 S236 R237 M239 Y244 F267 S268 I269 D272	I211-R213 HydrophobicContact CB-CG 4.36Å; I211-R213 HydrophobicContact CD1-CG 3.73Å; I211-R213 HydrophobicContact CG1-CG 3.99Å; I211-S236 WeakPolarHBondContact O-CA 3.47Å; I211-S236 WeakPolarHBondContact O-CB 3.37Å; I211-R237 HydrophobicContact CG1-CB 4.19Å; I211-R237 PolarHBondContact N-O 3.28Å; I211-R237 VanDerWaalsContact N-O 3.08Å; I211-R237 PolarHBondContact O-N 3.17Å; I211-R237 VanDerWaalsContact O-N 3.12Å; I211-M239 HydrophobicContact CB-SD 4.49Å; I211-M239 HydrophobicContact CD1-CE 4.49Å; I211-M239 HydrophobicContact CD1-SD 3.45Å; I211-M239 WeakPolarHBondContact CD1-SD 3.41Å; I211-M239 HydrophobicContact CG1-CG 4.18Å; I211-M239 HydrophobicContact CG1-SD 3.72Å; I211-M239 HydrophobicContact CG2-CG 3.75Å; I211-M239 HydrophobicContact CG2-SD 3.97Å; I211-Y244 HydrophobicContact CD1-CG 4.34Å; I211-F267 HydrophobicContact CD1-CB 3.95Å; I211-S268 VanDerWaalsContact CG2-C 3.48Å; I211-I269 HydrophobicContact CG2-CB 4.49Å; I211-D272 WeakPolarHBondContact CA-OD2 3.46Å
212	H	93.6	Very high	95.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.148	C	C	.	.			trans	-87	-47.2	-178.6	-169.1	-80.2	0	0	0	112	M202 D214 L215 V230 A231 D272	M202-H212 HydrophobicContact CE-CB 4.01Å; H212-D214 PolarHBondContact CE1-O 3.38Å; H212-D214 PolarHBondContact ND1-N 3.26Å; H212-D214 PolarHBondContact ND1-O 3.4Å; H212-D214 PolarHBondContact O-N 3.41Å; H212-D214 VanDerWaalsContact O-N 3.1Å; H212-L215 PolarHBondContact ND1-N 3.5Å; H212-V230 WeakPolarHBondContact NE2-CG1 3.4Å; H212-A231 PolarHBondContact CE1-O 3.09Å; H212-A231 PolarHBondContact NE2-O 3.49Å; H212-D272 PolarHBondContact N-OD2 3.07Å
213	R	92.3	Very high	95.2	Very high	31 Å²	31	32.8 Å²	32.8	12%	0.117	15%	0.151	C	C	.	.	S	Bend	trans	68	-14	179.9	-49.4	-172.6	-55.4	177	7	117.5	I211 L235 Y244 F267 D272	I211-R213 HydrophobicContact CB-CG 4.36Å; I211-R213 HydrophobicContact CD1-CG 3.73Å; I211-R213 HydrophobicContact CG1-CG 3.99Å; R213-L235 HydrophobicContact CB-CB 4.43Å; R213-L235 PolarHBondContact NE-O 3.47Å; R213-L235 PolarHBondContact NH2-O 3.46Å; R213-Y244 VanDerWaalsContact NH1-CZ 3.35Å; R213-Y244 PolarHBondContact NH1-OH 3Å; R213-F267 HydrophobicContact CB-CD1 4.17Å; R213-F267 HydrophobicContact CB-CE1 4.48Å; R213-F267 HydrophobicContact CG-CB 4.29Å; R213-F267 HydrophobicContact CG-CD1 4.03Å; R213-F267 HydrophobicContact CG-CG 4.28Å; R213-D272 WeakPolarHBondContact CA-OD1 3.29Å; R213-D272 PolarHBondContact N-OD1 3.39Å
214	D	92.1	Very high	95.1	Very high	19 Å²	19	34.3 Å²	34.3	10%	0.102	16%	0.158	C	C	.	.			trans	-131.5	43.8	175	-164.2	22.8	0	0	0	112.7	H212 A216 R218 N219 L235 P253	H212-D214 PolarHBondContact CE1-O 3.38Å; H212-D214 PolarHBondContact ND1-N 3.26Å; H212-D214 PolarHBondContact ND1-O 3.4Å; H212-D214 PolarHBondContact O-N 3.41Å; H212-D214 VanDerWaalsContact O-N 3.1Å; D214-A216 PolarHBondContact O-N 3.25Å; D214-R218 IonicContact OD1-CZ 3.8Å; D214-R218 IonicContact OD1-NH2 3.59Å; D214-R218 PolarHBondContact OD1-NH2 3.49Å; D214-R218 IonicContact OD2-NH2 3.77Å; D214-N219 PolarHBondContact O-ND2 3.27Å; D214-N219 PolarHBondContact OD2-ND2 3.39Å; D214-L235 HydrophobicContact CB-CD1 3.66Å; D214-P253 WeakPolarHBondContact OD1-CG 3.2Å
215	L	97.4	Very high	95.1	Very high	1 Å²	1	35 Å²	35	1%	0.005	16%	0.164	C	C	.	.			trans	-73.3	115.5	178.7	-175.7	64.9	0	0	0	110.1	I198 M202 H212 V230 A275 F276 L279 F337	I198-L215 HydrophobicContact CG2-CD1 4.3Å; M202-L215 HydrophobicContact CE-CD2 4.09Å; M202-L215 HydrophobicContact CG-CD2 3.9Å; M202-L215 HydrophobicContact SD-CD1 3.96Å; M202-L215 HydrophobicContact SD-CD2 3.92Å; H212-L215 PolarHBondContact ND1-N 3.5Å; L215-V230 HydrophobicContact CD1-CG1 4Å; L215-V230 HydrophobicContact CD1-CG2 4.34Å; L215-A275 HydrophobicContact CB-CB 4.06Å; L215-F276 HydrophobicContact CD2-CB 3.79Å; L215-F276 HydrophobicContact CD2-CD2 4.22Å; L215-L279 HydrophobicContact CD1-CD1 4.13Å; L215-L279 HydrophobicContact CG-CD1 4.15Å; L215-F337 HydrophobicContact CD2-CZ 4.41Å
216	A	97.6	Very high	95.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-160	161.3	179.2	0	0	0	0	0	110.1	D214 R218 N219 C220 W256	D214-A216 PolarHBondContact O-N 3.25Å; A216-R218 HydrophobicContact CB-CG 3.98Å; A216-R218 VanDerWaalsContact CB-NH1 3.3Å; A216-R218 PolarHBondContact O-N 3.3Å; A216-N219 PolarHBondContact O-N 3.17Å; A216-C220 PolarHBondContact O-N 2.75Å; A216-W256 HydrophobicContact CB-CD2 4.27Å; A216-W256 HydrophobicContact CB-CG 4.18Å
217	A	98.3	Very high	95.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-59.1	-32.3	-178.3	0	0	0	0	0	112.9	L174 L175 N219 C220 E282	L174-A217 WeakPolarHBondContact CB-O 3.37Å; L174-A217 PolarHBondContact N-O 2.98Å; L175-A217 HydrophobicContact CB-CB 3.91Å; L175-A217 HydrophobicContact CD1-CB 4.37Å; L175-A217 PolarHBondContact N-O 2.85Å; A217-N219 PolarHBondContact O-N 3.3Å; A217-C220 PolarHBondContact O-N 2.91Å; A217-E282 HydrophobicContact CB-CB 4.19Å; A217-E282 WeakPolarHBondContact CB-OE1 3.27Å; A217-E282 PolarHBondContact N-OE2 2.84Å; A217-E282 VanDerWaalsContact N-OE2 3.16Å
218	R	95.8	Very high	95.6	Very high	71 Å²	71	30 Å²	30	27%	0.268	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-61.4	-23.3	173.8	65.2	175.7	177.4	-78.3	-6.9	114.2	N173 L175 D214 A216	N173-R218 WeakPolarHBondContact CB-O 3.43Å; L175-R218 HydrophobicContact CD2-CB 4.3Å; D214-R218 IonicContact OD1-CZ 3.8Å; D214-R218 IonicContact OD1-NH2 3.59Å; D214-R218 PolarHBondContact OD1-NH2 3.49Å; D214-R218 IonicContact OD2-NH2 3.77Å; A216-R218 HydrophobicContact CB-CG 3.98Å; A216-R218 VanDerWaalsContact CB-NH1 3.3Å; A216-R218 PolarHBondContact O-N 3.3Å
219	N	95.6	Very high	95.9	Very high	19 Å²	19	25.1 Å²	25.1	10%	0.102	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-106.2	12.5	-179.3	-66.8	-21.5	0	0	0	112.2	D214 A216 A217 A231	D214-N219 PolarHBondContact O-ND2 3.27Å; D214-N219 PolarHBondContact OD2-ND2 3.39Å; A216-N219 PolarHBondContact O-N 3.17Å; A217-N219 PolarHBondContact O-N 3.3Å; N219-A231 PolarHBondContact O-N 3.1Å
220	C	97.9	Very high	96.2	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	134.1	166.1	-69.2	0	0	0	0	108	N173 L174 I198 A216 A217 V228	N173-C220 CarbonylContact C-O 3.49Å; N173-C220 WeakPolarHBondContact CA-O 3.49Å; L174-C220 HydrophobicContact CB-CB 3.8Å; L174-C220 HydrophobicContact CD2-CB 3.97Å; L174-C220 PolarHBondContact N-O 3.05Å; I198-C220 HydrophobicContact CD1-CB 4.37Å; A216-C220 PolarHBondContact O-N 2.75Å; A217-C220 PolarHBondContact O-N 2.91Å; C220-V228 HydrophobicContact CB-CG1 3.96Å
221	L	97.6	Very high	96.3	Very high	44 Å²	44	19.6 Å²	19.6	23%	0.23	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	144.3	-178.8	-60.6	-177.8	0	0	0	111.3	V150 M169 G172 N173 V228 K229 A231	V150-L221 HydrophobicContact CG2-CD1 4Å; M169-L221 HydrophobicContact CB-CB 3.61Å; M169-L221 HydrophobicContact CB-CD1 4.04Å; M169-L221 HydrophobicContact CB-CG 4.41Å; M169-L221 HydrophobicContact CE-CB 4.23Å; M169-L221 WeakPolarHBondContact CE-O 3.49Å; M169-L221 HydrophobicContact CG-CB 3.57Å; M169-L221 HydrophobicContact CG-CD1 3.76Å; M169-L221 HydrophobicContact CG-CG 4.33Å; G172-L221 CarbonylContact O-C 3.58Å; G172-L221 VanDerWaalsContact O-CA 3.29Å; G172-L221 WeakPolarHBondContact O-CA 3.4Å; N173-L221 HydrophobicContact CB-CD2 4.05Å; L221-V228 WeakPolarHBondContact O-CA 3.4Å; L221-K229 PolarHBondContact N-O 2.75Å; L221-K229 PolarHBondContact O-N 2.91Å; L221-A231 HydrophobicContact CD1-CB 3.79Å; L221-A231 HydrophobicContact CG-CB 3.81Å
222	V	98.4	Very high	95.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.2	-175.4	-172.9	0	0	0	0	110.1	M169 T170 Y171 G172 L174 Y177 L227 V228	M169-V222 CarbonylContact C-O 3.55Å; T170-V222 PolarHBondContact N-O 2.89Å; Y171-V222 PolarHBondContact N-O 3.34Å; G172-V222 PolarHBondContact O-N 3.34Å; L174-V222 HydrophobicContact CB-CG2 3.99Å; L174-V222 HydrophobicContact CD1-CG2 3.84Å; Y177-V222 HydrophobicContact CD1-CG1 4.33Å; Y177-V222 HydrophobicContact CD1-CG2 4.21Å; Y177-V222 HydrophobicContact CD2-CB 4.45Å; Y177-V222 HydrophobicContact CD2-CG1 4.12Å; Y177-V222 HydrophobicContact CE1-CG1 4.36Å; Y177-V222 HydrophobicContact CE2-CG1 4.15Å; Y177-V222 HydrophobicContact CG-CB 4.36Å; Y177-V222 HydrophobicContact CG-CG1 4.22Å; Y177-V222 HydrophobicContact CG-CG2 4.02Å; V222-L227 WeakPolarHBondContact CA-O 3.36Å; V222-V228 HydrophobicContact CG2-CG2 4.43Å
223	G	97	Very high	94.6	Very high	6 Å²	6	21.5 Å²	21.5	6%	0.062	11%	0.105	C	C	.	.			trans	-116.4	-167.2	174.8	0	0	0	0	0	111.5	Y171 L227	Y171-G223 WeakPolarHBondContact CD2-O 3.31Å; G223-L227 PolarHBondContact N-O 3.2Å
224	E	96.3	Very high	93.4	Very high	86 Å²	86	20.1 Å²	20.1	40%	0.402	10%	0.101	S	C	.	.	G	3₁₀ helix	trans	-57.4	143.7	-179.4	-60	-54.9	142.9	0	0	113.4	T170 Y171 H226 L227	T170-E224 WeakPolarHBondContact CB-OE1 3.25Å; T170-E224 PolarHBondContact OG1-OE1 3.5Å; Y171-E224 WeakPolarHBondContact CE2-OE1 3.47Å; Y171-E224 WeakPolarHBondContact CE2-OE2 3.5Å; Y171-E224 PolarHBondContact OH-OE2 2.76Å; E224-H226 VanDerWaalsContact C-N 3.3Å; E224-H226 PolarHBondContact O-N 3.36Å; E224-L227 WeakPolarHBondContact O-CB 3.34Å; E224-L227 PolarHBondContact O-N 3.3Å
225	N	96.6	Very high	92.3	Very high	52 Å²	52	20.4 Å²	20.4	28%	0.278	10%	0.102	S	C	.	.	G	3₁₀ helix	trans	58.3	37.4	176.6	-51.1	-72.2	0	0	0	113.9	R71 N72 L227	R71-N225 WeakPolarHBondContact CB-ND2 3.28Å; R71-N225 WeakPolarHBondContact CD-OD1 3.25Å; R71-N225 PolarHBondContact NH1-OD1 2.81Å; R71-N225 VanDerWaalsContact NH1-OD1 3.16Å; N72-N225 PolarHBondContact OD1-ND2 3.28Å; N225-L227 PolarHBondContact O-N 2.96Å
226	H	97.9	Very high	91.3	Very high	36 Å²	36	20.6 Å²	20.6	17%	0.167	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	61	27.5	-179.8	-43.3	102.8	0	0	0	113.5	Y177 V190 Y193 Q197 E224 V228	Y177-H226 PolarHBondContact OH-CD2 3.29Å; Y177-H226 PolarHBondContact OH-NE2 3.11Å; V190-H226 HydrophobicContact CG1-CB 3.93Å; Y193-H226 HydrophobicContact CD1-CB 4.23Å; Y193-H226 HydrophobicContact CE1-CB 4.35Å; Q197-H226 PolarHBondContact NE2-O 2.93Å; E224-H226 VanDerWaalsContact C-N 3.3Å; E224-H226 PolarHBondContact O-N 3.36Å; H226-V228 PolarHBondContact O-N 2.99Å
227	L	98.5	Very high	90.4	Very high	34 Å²	34	22.8 Å²	22.8	18%	0.178	11%	0.112	C	C	.	.			trans	-66.5	125.7	169.4	175.3	66.2	0	0	0	108.7	V222 G223 E224 N225 K229	V222-L227 WeakPolarHBondContact CA-O 3.36Å; G223-L227 PolarHBondContact N-O 3.2Å; E224-L227 WeakPolarHBondContact O-CB 3.34Å; E224-L227 PolarHBondContact O-N 3.3Å; N225-L227 PolarHBondContact O-N 2.96Å; L227-K229 HydrophobicContact CG-CG 4.48Å
228	V	98.6	Very high	89.5	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135.6	176.3	-178.8	0	0	0	0	110.3	N148 M194 Q197 I198 C220 L221 V222 H226	N148-V228 PolarHBondContact ND2-O 3.32Å; M194-V228 HydrophobicContact CB-CG2 3.82Å; M194-V228 HydrophobicContact CG-CG2 3.56Å; M194-V228 HydrophobicContact SD-CG2 3.9Å; Q197-V228 HydrophobicContact CB-CB 4.42Å; I198-V228 HydrophobicContact CD1-CG1 3.96Å; I198-V228 HydrophobicContact CG1-CG1 3.71Å; C220-V228 HydrophobicContact CB-CG1 3.96Å; L221-V228 WeakPolarHBondContact O-CA 3.4Å; V222-V228 HydrophobicContact CG2-CG2 4.43Å; H226-V228 PolarHBondContact O-N 2.99Å
229	K	98.4	Very high	88.8	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.009	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.4	173.4	-57.7	-166.2	177.9	-154.8	0	111	P147 N148 V150 E167 M169 L221 L227	P147-K229 WeakPolarHBondContact O-CE 3.47Å; P147-K229 PolarHBondContact O-NZ 3.45Å; N148-K229 CarbonylContact O-C 3.47Å; N148-K229 VanDerWaalsContact O-CA 3.26Å; N148-K229 WeakPolarHBondContact O-CA 3.45Å; V150-K229 HydrophobicContact CG2-CB 3.86Å; E167-K229 VanDerWaalsContact OE1-CD 3.23Å; E167-K229 WeakPolarHBondContact OE1-CD 3.33Å; E167-K229 WeakPolarHBondContact OE1-CE 3.49Å; E167-K229 IonicContact OE1-NZ 3.55Å; E167-K229 PolarHBondContact OE1-NZ 3.16Å; E167-K229 WeakPolarHBondContact OE2-CE 3.47Å; E167-K229 IonicContact OE2-NZ 2.78Å; E167-K229 PolarHBondContact OE2-NZ 3.35Å; M169-K229 HydrophobicContact CE-CB 3.96Å; M169-K229 HydrophobicContact CE-CD 4.02Å; M169-K229 HydrophobicContact CE-CG 3.69Å; M169-K229 HydrophobicContact SD-CD 3.91Å; M169-K229 HydrophobicContact SD-CG 4.24Å; L221-K229 PolarHBondContact N-O 2.75Å; L221-K229 PolarHBondContact O-N 2.91Å; L227-K229 HydrophobicContact CG-CG 4.48Å
230	V	97.4	Very high	87.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	137.4	171.7	-178.5	0	0	0	0	109	N148 L149 V150 I198 A201 H212 L215	N148-V230 PolarHBondContact O-N 3.18Å; L149-V230 HydrophobicContact CD2-CB 3.89Å; L149-V230 HydrophobicContact CD2-CG1 4.45Å; V150-V230 PolarHBondContact N-O 3.41Å; I198-V230 HydrophobicContact CB-CG2 4.46Å; I198-V230 HydrophobicContact CG1-CG2 4.43Å; I198-V230 HydrophobicContact CG2-CG2 3.92Å; A201-V230 HydrophobicContact CB-CB 4.42Å; A201-V230 HydrophobicContact CB-CG2 3.87Å; H212-V230 WeakPolarHBondContact NE2-CG1 3.4Å; L215-V230 HydrophobicContact CD1-CG1 4Å; L215-V230 HydrophobicContact CD1-CG2 4.34Å
231	A	91.5	Very high	86.9	Confident	10 Å²	10	34.2 Å²	34.2	8%	0.083	19%	0.192	C	C	.	.			trans	-132.5	178.5	-173.2	0	0	0	0	0	111.4	V150 H212 N219 L221	V150-A231 HydrophobicContact CB-CB 4.44Å; V150-A231 HydrophobicContact CG2-CB 3.62Å; H212-A231 PolarHBondContact CE1-O 3.09Å; H212-A231 PolarHBondContact NE2-O 3.49Å; N219-A231 PolarHBondContact O-N 3.1Å; L221-A231 HydrophobicContact CD1-CB 3.79Å; L221-A231 HydrophobicContact CG-CB 3.81Å
232	D	79.8	Confident	86	Confident	37 Å²	37	39.5 Å²	39.5	20%	0.198	22%	0.221	C	C	.	.			trans	64.9	69.7	179	-157.7	1.1	0	0	0	115.3	G234	D232-G234 PolarHBondContact O-N 2.91Å; D232-G234 PolarHBondContact OD1-N 3.03Å
233	F	71.6	Confident	85.4	Confident	3 Å²	3	43 Å²	43	1%	0.013	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-81.6	9.1	176.1	-56.1	-78.9	0	0	0	113.7	E137 V140 M141 I144 L149 L205 L235 S236	E137-F233 HydrophobicContact CG-CB 4.38Å; V140-F233 HydrophobicContact CG1-CB 4.49Å; M141-F233 HydrophobicContact CE-CD2 4.26Å; M141-F233 HydrophobicContact CE-CE2 4.4Å; M141-F233 HydrophobicContact CG-CD2 3.96Å; M141-F233 HydrophobicContact SD-CD2 4.31Å; I144-F233 HydrophobicContact CD1-CD1 3.7Å; I144-F233 HydrophobicContact CD1-CE1 3.61Å; I144-F233 HydrophobicContact CD1-CE2 4.41Å; I144-F233 HydrophobicContact CD1-CG 4.18Å; I144-F233 HydrophobicContact CD1-CZ 3.99Å; L149-F233 HydrophobicContact CB-CZ 4.12Å; L149-F233 HydrophobicContact CD2-CE1 3.78Å; L149-F233 HydrophobicContact CD2-CZ 3.54Å; L149-F233 HydrophobicContact CG-CZ 4.35Å; L205-F233 HydrophobicContact CD1-CE1 4.44Å; F233-L235 PolarHBondContact O-N 3.07Å; F233-S236 WeakPolarHBondContact CA-OG 3.36Å; F233-S236 WeakPolarHBondContact CD1-OG 3.26Å; F233-S236 VanDerWaalsContact O-CB 3.31Å; F233-S236 WeakPolarHBondContact O-CB 3.48Å; F233-S236 PolarHBondContact O-N 2.63Å
234	G	66.6	Low	84.9	Confident	2 Å²	2	45.1 Å²	45.1	2%	0.021	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-60.5	-33.2	-178.3	0	0	0	0	0	112.7	D232 R237	D232-G234 PolarHBondContact O-N 2.91Å; D232-G234 PolarHBondContact OD1-N 3.03Å; G234-R237 PolarHBondContact O-NH1 3.22Å; G234-R237 VanDerWaalsContact O-NH1 3.11Å
235	L	68.5	Low	84.5	Confident	26 Å²	26	45.1 Å²	45.1	14%	0.136	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-88.8	-5.7	172.3	-72.1	167.9	0	0	0	113.1	Y104 R213 D214 F233	Y104-L235 HydrophobicContact CE2-CD2 4.3Å; Y104-L235 HydrophobicContact CE2-CG 3.98Å; Y104-L235 WeakPolarHBondContact OH-CD2 3.39Å; R213-L235 HydrophobicContact CB-CB 4.43Å; R213-L235 PolarHBondContact NE-O 3.47Å; R213-L235 PolarHBondContact NH2-O 3.46Å; D214-L235 HydrophobicContact CB-CD1 3.66Å; F233-L235 PolarHBondContact O-N 3.07Å
236	S	77.7	Confident	83.9	Confident	4 Å²	4	43.1 Å²	43.1	3%	0.028	25%	0.245	C	C	.	.			trans	-70.3	147.5	-175.8	-66.4	0	0	0	0	112.1	I211 F233	I211-S236 WeakPolarHBondContact O-CA 3.47Å; I211-S236 WeakPolarHBondContact O-CB 3.37Å; F233-S236 WeakPolarHBondContact CA-OG 3.36Å; F233-S236 WeakPolarHBondContact CD1-OG 3.26Å; F233-S236 VanDerWaalsContact O-CB 3.31Å; F233-S236 WeakPolarHBondContact O-CB 3.48Å; F233-S236 PolarHBondContact O-N 2.63Å
237	R	78.9	Confident	83.2	Confident	46 Å²	46	48.3 Å²	48.3	17%	0.174	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	138.4	179.8	-63	-66.1	-178.5	-97.7	6.3	110.2	E133 I211 G234 Y244	E133-R237 IonicContact OE1-NH2 3.59Å; E133-R237 PolarHBondContact OE1-NH2 2.79Å; I211-R237 HydrophobicContact CG1-CB 4.19Å; I211-R237 PolarHBondContact N-O 3.28Å; I211-R237 VanDerWaalsContact N-O 3.08Å; I211-R237 PolarHBondContact O-N 3.17Å; I211-R237 VanDerWaalsContact O-N 3.12Å; G234-R237 PolarHBondContact O-NH1 3.22Å; G234-R237 VanDerWaalsContact O-NH1 3.11Å; R237-Y244 HydrophobicContact CG-CE2 4.44Å
238	L	79.1	Confident	82.3	Confident	104 Å²	104	51.6 Å²	51.6	55%	0.545	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128.9	165.3	-178.4	68.6	0	0	0	108.3	K208 N209 F210	K208-L238 WeakPolarHBondContact O-CD1 3.45Å; N209-L238 HydrophobicContact CB-CD1 4.35Å; F210-L238 HydrophobicContact CD1-CB 4.33Å; F210-L238 HydrophobicContact CD2-CD1 4.14Å; F210-L238 HydrophobicContact CE1-CB 3.8Å; F210-L238 HydrophobicContact CE1-CD1 4.34Å; F210-L238 HydrophobicContact CE2-CD1 3.81Å; F210-L238 HydrophobicContact CZ-CB 4.03Å; F210-L238 HydrophobicContact CZ-CD1 3.93Å
239	M	80.5	Confident	81.2	Confident	32 Å²	32	55 Å²	55	16%	0.158	34%	0.337	C	S	.	.			trans	-84.9	125.3	-178.6	-65.6	-63.3	-71.5	0	0	110.6	N209 I211 G241 T243 Y244	N209-M239 WeakPolarHBondContact O-CB 3.05Å; N209-M239 PolarHBondContact O-N 2.91Å; I211-M239 HydrophobicContact CB-SD 4.49Å; I211-M239 HydrophobicContact CD1-CE 4.49Å; I211-M239 HydrophobicContact CD1-SD 3.45Å; I211-M239 WeakPolarHBondContact CD1-SD 3.41Å; I211-M239 HydrophobicContact CG1-CG 4.18Å; I211-M239 HydrophobicContact CG1-SD 3.72Å; I211-M239 HydrophobicContact CG2-CG 3.75Å; I211-M239 HydrophobicContact CG2-SD 3.97Å; M239-G241 WeakPolarHBondContact CE-O 3.42Å; M239-T243 VanDerWaalsContact CE-CA 3.49Å; M239-Y244 VanDerWaalsContact CE-N 3.33Å
240	T	74.6	Confident	80.3	Confident	154 Å²	154	56.8 Å²	56.8	95%	0.945	35%	0.352	S	S	*	.	S	Bend	trans	-94.9	-4.6	170.7	52.4	0	0	0	0	112.9
241	G	78.5	Confident	79.4	Confident	40 Å²	40	66.1 Å²	66.1	41%	0.412	39%	0.393	S	S	.	.	S	Bend	trans	-161.9	-171.4	175.2	0	0	0	0	0	110	M239 T243	M239-G241 WeakPolarHBondContact CE-O 3.42Å; G241-T243 VanDerWaalsContact C-N 3.31Å; G241-T243 PolarHBondContact O-N 2.82Å
242	D	79.9	Confident	79	Confident	155 Å²	155	68.1 Å²	68.1	83%	0.829	40%	0.399	S	S	*	.	S	Bend	trans	-75	-17.3	-168.4	-59.1	-33	0	0	0	114.7	S268	D242-S268 WeakPolarHBondContact O-CB 3.32Å
243	T	85.8	Confident	79.6	Confident	75 Å²	75	68.2 Å²	68.2	46%	0.46	40%	0.402	S	S	.	.			trans	-144.4	137.7	-175.6	-54.3	0	0	0	0	111.4	M239 G241 K266 F267	M239-T243 VanDerWaalsContact CE-CA 3.49Å; G241-T243 VanDerWaalsContact C-N 3.31Å; G241-T243 PolarHBondContact O-N 2.82Å; T243-K266 HydrophobicContact CG2-CB 3.68Å; T243-K266 HydrophobicContact CG2-CD 4.19Å; T243-K266 HydrophobicContact CG2-CG 3.87Å; T243-F267 CarbonylContact C-O 3.57Å; T243-F267 WeakPolarHBondContact CA-O 3.21Å; T243-F267 WeakPolarHBondContact CG2-O 3.23Å
244	Y	87.1	Confident	80.7	Confident	50 Å²	50	71 Å²	71	20%	0.196	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133.9	170.2	172.5	-90.6	0	0	0	109.2	I211 R213 R237 M239 A246 K266 F267	I211-Y244 HydrophobicContact CD1-CG 4.34Å; R213-Y244 VanDerWaalsContact NH1-CZ 3.35Å; R213-Y244 PolarHBondContact NH1-OH 3Å; R237-Y244 HydrophobicContact CG-CE2 4.44Å; M239-Y244 VanDerWaalsContact CE-N 3.33Å; Y244-A246 HydrophobicContact CE1-CB 3.87Å; Y244-K266 CarbonylContact O-C 3.53Å; Y244-K266 WeakPolarHBondContact O-CA 3.36Å; Y244-F267 HydrophobicContact CD1-CB 4.39Å; Y244-F267 HydrophobicContact CD1-CD2 4.27Å; Y244-F267 PolarHBondContact N-O 3.16Å; Y244-F267 PolarHBondContact O-N 2.85Å
245	T	87.8	Confident	82.2	Confident	86 Å²	86	72.6 Å²	72.6	53%	0.528	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.2	174.8	-54.5	0	0	0	0	109.4	N265	T245-N265 WeakPolarHBondContact CA-O 3.5Å
246	A	83.6	Confident	83.6	Confident	9 Å²	9	73 Å²	73	7%	0.074	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-75	155.1	176.2	0	0	0	0	0	111.6	Y244 A250 F252 N265 F267	Y244-A246 HydrophobicContact CE1-CB 3.87Å; A246-A250 HydrophobicContact CB-CB 4.39Å; A246-F252 HydrophobicContact CB-CE1 4.24Å; A246-F252 HydrophobicContact CB-CZ 3.67Å; A246-N265 HydrophobicContact CB-CB 4.22Å; A246-N265 PolarHBondContact N-O 3.01Å; A246-F267 HydrophobicContact CB-CD2 4.22Å; A246-F267 HydrophobicContact CB-CE2 3.81Å
247	H	82.5	Confident	84.6	Confident	145 Å²	145	73.3 Å²	73.3	67%	0.671	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-59.7	145.8	178.3	-46.2	-60.2	0	0	0	111.5	G249 A250 N265	H247-G249 PolarHBondContact O-N 3.26Å; H247-A250 WeakPolarHBondContact O-CB 3.12Å; H247-A250 PolarHBondContact O-N 3.37Å; H247-N265 PolarHBondContact O-ND2 2.57Å
248	A	79	Confident	85.5	Confident	103 Å²	103	71.2 Å²	71.2	85%	0.851	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	134.7	175.9	0	0	0	0	0	110.6
249	G	76.6	Confident	86.4	Confident	72 Å²	72	66.4 Å²	66.4	74%	0.742	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	1.1	-177.4	0	0	0	0	0	115.5	H247 K251	H247-G249 PolarHBondContact O-N 3.26Å; G249-K251 PolarHBondContact O-N 2.82Å
250	A	78.4	Confident	87.2	Confident	40 Å²	40	66 Å²	66	33%	0.331	39%	0.389	S	S	.	.			trans	-59.7	135.6	169.6	0	0	0	0	0	110.9	A246 H247 F252	A246-A250 HydrophobicContact CB-CB 4.39Å; H247-A250 WeakPolarHBondContact O-CB 3.12Å; H247-A250 PolarHBondContact O-N 3.37Å; A250-F252 HydrophobicContact CB-CE1 3.78Å; A250-F252 HydrophobicContact CB-CE2 4.02Å; A250-F252 HydrophobicContact CB-CZ 3.33Å; A250-F252 WeakPolarHBondContact O-CE2 3.45Å
251	K	79.9	Confident	88.2	Confident	196 Å²	196	58.7 Å²	58.7	85%	0.852	35%	0.345	S	S	*	.			trans	-92.5	135.7	178.7	-65.3	-178.1	-179.4	178.5	0	109.5	G249	G249-K251 PolarHBondContact O-N 2.82Å
252	F	82.2	Confident	89	Confident	51 Å²	51	59 Å²	59	22%	0.224	34%	0.336	C	S	.	.			trans	-128.7	152.4	-179.3	-51.8	-62.3	0	0	0	111.4	A246 A250 I254 T257 F267	A246-F252 HydrophobicContact CB-CE1 4.24Å; A246-F252 HydrophobicContact CB-CZ 3.67Å; A250-F252 HydrophobicContact CB-CE1 3.78Å; A250-F252 HydrophobicContact CB-CE2 4.02Å; A250-F252 HydrophobicContact CB-CZ 3.33Å; A250-F252 WeakPolarHBondContact O-CE2 3.45Å; F252-I254 PolarHBondContact O-N 3.09Å; F252-T257 HydrophobicContact CB-CG2 4.19Å; F252-F267 HydrophobicContact CD1-CE1 4.44Å; F252-F267 HydrophobicContact CD1-CE2 4.44Å; F252-F267 AromaticContact CD1-CZ 3.65Å; F252-F267 HydrophobicContact CD1-CZ 3.65Å; F252-F267 HydrophobicContact CD2-CZ 4.21Å; F252-F267 HydrophobicContact CE1-CE1 4.49Å; F252-F267 AromaticContact CE1-CE2 3.79Å; F252-F267 HydrophobicContact CE1-CE2 3.79Å; F252-F267 AromaticContact CE1-CZ 3.44Å; F252-F267 HydrophobicContact CE1-CZ 3.44Å; F252-F267 VanDerWaalsContact CE1-CZ 3.44Å; F252-F267 HydrophobicContact CE2-CE2 4.2Å; F252-F267 HydrophobicContact CE2-CZ 4.02Å; F252-F267 HydrophobicContact CG-CZ 4.03Å; F252-F267 AromaticContact CZ-CE2 3.64Å; F252-F267 HydrophobicContact CZ-CE2 3.64Å; F252-F267 AromaticContact CZ-CZ 3.63Å; F252-F267 HydrophobicContact CZ-CZ 3.63Å
253	P	92	Very high	89.6	Confident	39 Å²	39	53.6 Å²	53.6	25%	0.253	31%	0.313	S	S	.	.			trans	-72.4	91.2	174.5	31.6	-35.3	0	0	0	109.7	D214 K255 W256 T257	D214-P253 WeakPolarHBondContact OD1-CG 3.2Å; P253-K255 PolarHBondContact O-N 2.81Å; P253-W256 HydrophobicContact CB-CE3 3.98Å; P253-W256 PolarHBondContact O-N 2.83Å; P253-T257 VanDerWaalsContact C-OG1 3.29Å; P253-T257 PolarHBondContact O-N 3.04Å; P253-T257 PolarHBondContact O-OG1 3.21Å
254	I	95.6	Very high	89.9	Confident	61 Å²	61	57.1 Å²	57.1	31%	0.313	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-44	-46.7	-169.4	-66.1	172.4	0	0	0	113	F252 W256 T257 L262 L296 V299	F252-I254 PolarHBondContact O-N 3.09Å; I254-W256 VanDerWaalsContact C-N 3.25Å; I254-W256 PolarHBondContact O-N 2.79Å; I254-T257 PolarHBondContact O-N 2.87Å; I254-T257 VanDerWaalsContact O-N 3.11Å; I254-L262 HydrophobicContact CG1-CD2 4.42Å; I254-L262 HydrophobicContact CG2-CD2 4.3Å; I254-L296 HydrophobicContact CB-CD2 4.3Å; I254-L296 HydrophobicContact CD1-CB 4.1Å; I254-L296 HydrophobicContact CD1-CD1 4.46Å; I254-L296 HydrophobicContact CG2-CD2 4.32Å; I254-V299 HydrophobicContact CG2-CB 4.18Å; I254-V299 HydrophobicContact CG2-CG1 4.33Å; I254-V299 HydrophobicContact CG2-CG2 4.38Å
255	K	98.1	Very high	90.2	Very high	37 Å²	37	56.3 Å²	56.3	16%	0.161	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-63.6	-23.9	-176.3	-63	-178.6	175.5	-157.9	0	114.5	P253 S289 P290 Y291 L296	P253-K255 PolarHBondContact O-N 2.81Å; K255-S289 PolarHBondContact NZ-OG 2.74Å; K255-P290 HydrophobicContact CB-CB 4.23Å; K255-P290 HydrophobicContact CD-CB 4.24Å; K255-P290 WeakPolarHBondContact CD-O 3.19Å; K255-P290 WeakPolarHBondContact CE-O 3.36Å; K255-P290 PolarHBondContact NZ-O 3.23Å; K255-Y291 HydrophobicContact CB-CD2 3.97Å; K255-Y291 HydrophobicContact CB-CE2 4.16Å; K255-Y291 HydrophobicContact CD-CD2 4.49Å; K255-Y291 HydrophobicContact CG-CD2 4.01Å; K255-Y291 VanDerWaalsContact O-CE2 3.27Å; K255-Y291 WeakPolarHBondContact O-CE2 3.48Å; K255-L296 HydrophobicContact CD-CD2 4.11Å; K255-L296 VanDerWaalsContact CE-CD2 3.48Å; K255-L296 HydrophobicContact CG-CD2 3.63Å
256	W	98.4	Very high	90.5	Very high	35 Å²	35	56.9 Å²	56.9	13%	0.133	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-102.3	-5.8	177.9	-68.4	-99.7	0	0	0	112.6	A216 P253 I254 V278 E282 P290	A216-W256 HydrophobicContact CB-CD2 4.27Å; A216-W256 HydrophobicContact CB-CG 4.18Å; P253-W256 HydrophobicContact CB-CE3 3.98Å; P253-W256 PolarHBondContact O-N 2.83Å; I254-W256 VanDerWaalsContact C-N 3.25Å; I254-W256 PolarHBondContact O-N 2.79Å; W256-V278 HydrophobicContact CD2-CG1 4.33Å; W256-V278 HydrophobicContact CG-CB 4.43Å; W256-V278 HydrophobicContact CG-CG1 4.03Å; W256-E282 WeakPolarHBondContact CZ2-OE1 3.38Å; W256-E282 PolarHBondContact NE1-OE2 3.13Å; W256-P290 HydrophobicContact CH2-CG 4.16Å; W256-P290 HydrophobicContact CZ2-CG 3.75Å
257	T	97.6	Very high	91	Very high	10 Å²	10	56.8 Å²	56.8	6%	0.061	31%	0.312	C	S	.	.			trans	-89.8	129.8	-169.5	-54.5	0	0	0	0	110.1	F252 P253 I254 S261 L262	F252-T257 HydrophobicContact CB-CG2 4.19Å; P253-T257 VanDerWaalsContact C-OG1 3.29Å; P253-T257 PolarHBondContact O-N 3.04Å; P253-T257 PolarHBondContact O-OG1 3.21Å; I254-T257 PolarHBondContact O-N 2.87Å; I254-T257 VanDerWaalsContact O-N 3.11Å; T257-S261 VanDerWaalsContact CG2-CB 3.44Å; T257-L262 HydrophobicContact CG2-CD2 3.71Å; T257-L262 HydrophobicContact CG2-CG 3.79Å
258	A	98.2	Very high	91.7	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.008	29%	0.285	C	S	.	.			trans	-68.5	156	-179.7	0	0	0	0	0	112.3	E260 S261 L262 W274	A258-E260 VanDerWaalsContact C-N 3.34Å; A258-E260 WeakPolarHBondContact CB-OE1 3.38Å; A258-E260 WeakPolarHBondContact CB-OE2 3.49Å; A258-E260 PolarHBondContact O-N 3.37Å; A258-S261 WeakPolarHBondContact O-CA 3.48Å; A258-S261 WeakPolarHBondContact O-CB 3.32Å; A258-S261 PolarHBondContact O-N 3.08Å; A258-L262 PolarHBondContact O-N 3.12Å; A258-W274 HydrophobicContact CB-CB 3.77Å; A258-W274 HydrophobicContact CB-CD2 4.03Å; A258-W274 HydrophobicContact CB-CE3 4.48Å; A258-W274 HydrophobicContact CB-CG 3.67Å
259	P	98	Very high	92.5	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.019	25%	0.252	C	S	.	.	H	α-helix	trans	-55.4	-43	-177.3	-26.8	34.8	0	0	0	114.1	S261 L262 A263 W274 Y300 L303 W329	P259-S261 VanDerWaalsContact C-N 3.25Å; P259-S261 PolarHBondContact O-N 2.78Å; P259-L262 PolarHBondContact O-N 2.87Å; P259-A263 WeakPolarHBondContact O-CB 3.44Å; P259-A263 PolarHBondContact O-N 3.34Å; P259-W274 HydrophobicContact CG-CE3 4.44Å; P259-W274 HydrophobicContact CG-CH2 3.67Å; P259-W274 HydrophobicContact CG-CZ2 4.19Å; P259-W274 HydrophobicContact CG-CZ3 3.8Å; P259-Y300 HydrophobicContact CB-CE2 4.16Å; P259-L303 HydrophobicContact CG-CD1 4.43Å; P259-W329 HydrophobicContact CB-CE3 4.07Å; P259-W329 HydrophobicContact CB-CH2 3.91Å; P259-W329 HydrophobicContact CB-CZ2 4.37Å; P259-W329 HydrophobicContact CB-CZ3 3.72Å; P259-W329 HydrophobicContact CG-CE3 3.87Å; P259-W329 HydrophobicContact CG-CH2 4.5Å; P259-W329 HydrophobicContact CG-CZ3 3.81Å
260	E	97.4	Very high	93.5	Very high	24 Å²	24	45.9 Å²	45.9	11%	0.112	23%	0.226	C	C	.	.	H	α-helix	trans	-65.3	-29.9	177.6	71.8	-77.5	-171.1	0	0	113	A258 Y264 K266 P331 R334	A258-E260 VanDerWaalsContact C-N 3.34Å; A258-E260 WeakPolarHBondContact CB-OE1 3.38Å; A258-E260 WeakPolarHBondContact CB-OE2 3.49Å; A258-E260 PolarHBondContact O-N 3.37Å; E260-Y264 WeakPolarHBondContact O-CA 3.5Å; E260-Y264 WeakPolarHBondContact O-CB 3.3Å; E260-Y264 PolarHBondContact O-N 3.38Å; E260-K266 PolarHBondContact O-N 3.34Å; E260-P331 HydrophobicContact CG-CG 3.98Å; E260-R334 IonicContact OE1-CZ 3.88Å; E260-R334 IonicContact OE1-NH1 3.85Å; E260-R334 PolarHBondContact OE1-NH1 3.35Å; E260-R334 IonicContact OE1-NH2 2.6Å; E260-R334 IonicContact OE2-CZ 3.31Å; E260-R334 IonicContact OE2-NH1 2.7Å; E260-R334 PolarHBondContact OE2-NH1 2.66Å; E260-R334 IonicContact OE2-NH2 3.7Å; E260-R334 PolarHBondContact OE2-NH2 3.5Å
261	S	95.8	Very high	94.5	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.007	21%	0.212	C	C	.	.	H	α-helix	trans	-77.2	-38.6	176.4	-52.8	0	0	0	0	111.1	T257 A258 P259 N265 K266	T257-S261 VanDerWaalsContact CG2-CB 3.44Å; A258-S261 WeakPolarHBondContact O-CA 3.48Å; A258-S261 WeakPolarHBondContact O-CB 3.32Å; A258-S261 PolarHBondContact O-N 3.08Å; P259-S261 VanDerWaalsContact C-N 3.25Å; P259-S261 PolarHBondContact O-N 2.78Å; S261-N265 VanDerWaalsContact O-CA 3.25Å; S261-N265 WeakPolarHBondContact O-CA 3.34Å; S261-N265 PolarHBondContact O-N 3.36Å; S261-K266 VanDerWaalsContact CA-O 3.25Å; S261-K266 WeakPolarHBondContact CA-O 3.44Å; S261-K266 WeakPolarHBondContact CB-O 3.24Å; S261-K266 PolarHBondContact N-O 2.85Å; S261-K266 PolarHBondContact OG-O 3.49Å
262	L	94.1	Very high	95.4	Very high	45 Å²	45	35 Å²	35	24%	0.236	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-43.6	175.2	-71.5	174.3	0	0	0	112.4	I254 T257 A258 P259 Y300	I254-L262 HydrophobicContact CG1-CD2 4.42Å; I254-L262 HydrophobicContact CG2-CD2 4.3Å; T257-L262 HydrophobicContact CG2-CD2 3.71Å; T257-L262 HydrophobicContact CG2-CG 3.79Å; A258-L262 PolarHBondContact O-N 3.12Å; P259-L262 PolarHBondContact O-N 2.87Å; L262-Y300 HydrophobicContact CB-CD2 3.9Å; L262-Y300 HydrophobicContact CB-CE2 4.38Å; L262-Y300 HydrophobicContact CD1-CD2 4.03Å
263	A	93.1	Very high	96.1	Very high	42 Å²	42	32.6 Å²	32.6	35%	0.347	16%	0.161	S	C	.	.	H	α-helix	trans	-84.1	-36.8	-174.7	0	0	0	0	0	113.5	P259 Y300	P259-A263 WeakPolarHBondContact O-CB 3.44Å; P259-A263 PolarHBondContact O-N 3.34Å; A263-Y300 HydrophobicContact CB-CE2 3.83Å
264	Y	93.4	Very high	96.5	Very high	149 Å²	149	30.7 Å²	30.7	58%	0.584	15%	0.149	S	C	*	.	H	α-helix	trans	-128.1	6.9	-167	-47.8	-62.4	0	0	0	113.8	E260 K266	E260-Y264 WeakPolarHBondContact O-CA 3.5Å; E260-Y264 WeakPolarHBondContact O-CB 3.3Å; E260-Y264 PolarHBondContact O-N 3.38Å; Y264-K266 PolarHBondContact O-N 3.36Å; Y264-K266 VanDerWaalsContact O-N 3.09Å
265	N	92.7	Very high	96.6	Very high	33 Å²	33	28 Å²	28	18%	0.176	14%	0.136	C	C	.	.			trans	53.9	26.8	-175.7	-68.4	1.2	0	0	0	113.4	T245 A246 H247 S261 F267	T245-N265 WeakPolarHBondContact CA-O 3.5Å; A246-N265 HydrophobicContact CB-CB 4.22Å; A246-N265 PolarHBondContact N-O 3.01Å; H247-N265 PolarHBondContact O-ND2 2.57Å; S261-N265 VanDerWaalsContact O-CA 3.25Å; S261-N265 WeakPolarHBondContact O-CA 3.34Å; S261-N265 PolarHBondContact O-N 3.36Å; N265-F267 WeakPolarHBondContact O-CD2 3.34Å
266	K	94.3	Very high	96.7	Very high	99 Å²	99	26.4 Å²	26.4	43%	0.43	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	127.6	-178.9	-74.5	-177.2	-179.9	-177.5	0	110.8	T243 Y244 E260 S261 Y264	T243-K266 HydrophobicContact CG2-CB 3.68Å; T243-K266 HydrophobicContact CG2-CD 4.19Å; T243-K266 HydrophobicContact CG2-CG 3.87Å; Y244-K266 CarbonylContact O-C 3.53Å; Y244-K266 WeakPolarHBondContact O-CA 3.36Å; E260-K266 PolarHBondContact O-N 3.34Å; S261-K266 VanDerWaalsContact CA-O 3.25Å; S261-K266 WeakPolarHBondContact CA-O 3.44Å; S261-K266 WeakPolarHBondContact CB-O 3.24Å; S261-K266 PolarHBondContact N-O 2.85Å; S261-K266 PolarHBondContact OG-O 3.49Å; Y264-K266 PolarHBondContact O-N 3.36Å; Y264-K266 VanDerWaalsContact O-N 3.09Å
267	F	94.5	Very high	96.7	Very high	7 Å²	7	24.8 Å²	24.8	3%	0.031	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	143.5	179.5	-64.6	-93.8	0	0	0	110.2	I211 R213 T243 Y244 A246 F252 N265 S271	I211-F267 HydrophobicContact CD1-CB 3.95Å; R213-F267 HydrophobicContact CB-CD1 4.17Å; R213-F267 HydrophobicContact CB-CE1 4.48Å; R213-F267 HydrophobicContact CG-CB 4.29Å; R213-F267 HydrophobicContact CG-CD1 4.03Å; R213-F267 HydrophobicContact CG-CG 4.28Å; T243-F267 CarbonylContact C-O 3.57Å; T243-F267 WeakPolarHBondContact CA-O 3.21Å; T243-F267 WeakPolarHBondContact CG2-O 3.23Å; Y244-F267 HydrophobicContact CD1-CB 4.39Å; Y244-F267 HydrophobicContact CD1-CD2 4.27Å; Y244-F267 PolarHBondContact N-O 3.16Å; Y244-F267 PolarHBondContact O-N 2.85Å; A246-F267 HydrophobicContact CB-CD2 4.22Å; A246-F267 HydrophobicContact CB-CE2 3.81Å; F252-F267 HydrophobicContact CD1-CE1 4.44Å; F252-F267 HydrophobicContact CD1-CE2 4.44Å; F252-F267 AromaticContact CD1-CZ 3.65Å; F252-F267 HydrophobicContact CD1-CZ 3.65Å; F252-F267 HydrophobicContact CD2-CZ 4.21Å; F252-F267 HydrophobicContact CE1-CE1 4.49Å; F252-F267 AromaticContact CE1-CE2 3.79Å; F252-F267 HydrophobicContact CE1-CE2 3.79Å; F252-F267 AromaticContact CE1-CZ 3.44Å; F252-F267 HydrophobicContact CE1-CZ 3.44Å; F252-F267 VanDerWaalsContact CE1-CZ 3.44Å; F252-F267 HydrophobicContact CE2-CE2 4.2Å; F252-F267 HydrophobicContact CE2-CZ 4.02Å; F252-F267 HydrophobicContact CG-CZ 4.03Å; F252-F267 AromaticContact CZ-CE2 3.64Å; F252-F267 HydrophobicContact CZ-CE2 3.64Å; F252-F267 AromaticContact CZ-CZ 3.63Å; F252-F267 HydrophobicContact CZ-CZ 3.63Å; N265-F267 WeakPolarHBondContact O-CD2 3.34Å; F267-S271 WeakPolarHBondContact CA-OG 3.43Å
268	S	95.8	Very high	96.7	Very high	15 Å²	15	24.3 Å²	24.3	11%	0.105	12%	0.12	C	C	.	.			trans	-152.1	178.4	175.6	65.3	0	0	0	0	108.9	I211 D242 K270 S271 D272	I211-S268 VanDerWaalsContact CG2-C 3.48Å; D242-S268 WeakPolarHBondContact O-CB 3.32Å; S268-K270 PolarHBondContact O-N 3Å; S268-K270 VanDerWaalsContact O-N 3.16Å; S268-K270 PolarHBondContact OG-N 3.01Å; S268-S271 PolarHBondContact N-OG 2.96Å; S268-S271 PolarHBondContact O-N 2.77Å; S268-S271 PolarHBondContact O-OG 3.37Å; S268-S271 PolarHBondContact OG-N 2.94Å; S268-D272 PolarHBondContact O-N 3.17Å
269	I	96.7	Very high	96.8	Very high	34 Å²	34	24.2 Å²	24.2	17%	0.174	12%	0.119	C	C	.	.	H	α-helix	trans	-58.8	-28.4	171.1	-165.9	65.1	0	0	0	111.6	E206 I211 S271 D272 V273 F337	E206-I269 HydrophobicContact CB-CD1 3.91Å; E206-I269 HydrophobicContact CB-CG1 3.83Å; E206-I269 HydrophobicContact CG-CG1 3.88Å; I211-I269 HydrophobicContact CG2-CB 4.49Å; I269-S271 VanDerWaalsContact C-N 3.34Å; I269-S271 PolarHBondContact O-N 2.69Å; I269-D272 HydrophobicContact CD1-CB 4.45Å; I269-D272 WeakPolarHBondContact O-CB 3.41Å; I269-D272 PolarHBondContact O-N 3.22Å; I269-D272 VanDerWaalsContact O-N 3.11Å; I269-V273 WeakPolarHBondContact O-CG2 3.35Å; I269-V273 PolarHBondContact O-N 3.39Å; I269-F337 HydrophobicContact CD1-CD2 3.82Å; I269-F337 HydrophobicContact CD1-CE2 3.76Å; I269-F337 HydrophobicContact CG1-CD2 3.87Å; I269-F337 HydrophobicContact CG1-CE2 4.03Å
270	K	98.3	Very high	96.8	Very high	42 Å²	42	24.6 Å²	24.6	18%	0.183	12%	0.121	C	C	.	.	H	α-helix	trans	-72.8	-23.8	178	-60.7	-63	-176	172	0	113.4	S268 V273 W274 P331 R334 P335	S268-K270 PolarHBondContact O-N 3Å; S268-K270 VanDerWaalsContact O-N 3.16Å; S268-K270 PolarHBondContact OG-N 3.01Å; K270-V273 HydrophobicContact CD-CG2 4.47Å; K270-W274 PolarHBondContact O-N 3.07Å; K270-P331 HydrophobicContact CB-CB 3.72Å; K270-P331 WeakPolarHBondContact CD-O 2.91Å; K270-P331 HydrophobicContact CG-CB 4.34Å; K270-P331 VanDerWaalsContact CG-O 3.31Å; K270-P331 WeakPolarHBondContact CG-O 3.48Å; K270-R334 HydrophobicContact CD-CB 4.29Å; K270-R334 PolarHBondContact NZ-O 3.5Å; K270-R334 WeakPolarHBondContact O-CD 3.5Å; K270-R334 PolarHBondContact O-NH1 3.23Å; K270-P335 PolarHBondContact NZ-O 3Å
271	S	98.1	Very high	96.9	Very high	5 Å²	5	23.9 Å²	23.9	4%	0.035	12%	0.117	C	C	.	.	H	α-helix	trans	-74.4	-30.5	168.2	57.7	0	0	0	0	111.5	F267 S268 I269 W274 A275	F267-S271 WeakPolarHBondContact CA-OG 3.43Å; S268-S271 PolarHBondContact N-OG 2.96Å; S268-S271 PolarHBondContact O-N 2.77Å; S268-S271 PolarHBondContact O-OG 3.37Å; S268-S271 PolarHBondContact OG-N 2.94Å; I269-S271 VanDerWaalsContact C-N 3.34Å; I269-S271 PolarHBondContact O-N 2.69Å; S271-W274 WeakPolarHBondContact O-CB 3.43Å; S271-W274 PolarHBondContact O-N 3.29Å; S271-A275 PolarHBondContact O-N 2.78Å; S271-A275 VanDerWaalsContact O-N 3.14Å
272	D	98.3	Very high	97	Very high	2 Å²	2	24 Å²	24	1%	0.011	12%	0.117	C	C	.	.	H	α-helix	trans	-69.9	-34.5	171.2	-70.2	-25.3	0	0	0	111.8	M202 I211 H212 R213 S268 I269 W274 A275 F276 F337	M202-D272 HydrophobicContact CE-CB 3.9Å; I211-D272 WeakPolarHBondContact CA-OD2 3.46Å; H212-D272 PolarHBondContact N-OD2 3.07Å; R213-D272 WeakPolarHBondContact CA-OD1 3.29Å; R213-D272 PolarHBondContact N-OD1 3.39Å; S268-D272 PolarHBondContact O-N 3.17Å; I269-D272 HydrophobicContact CD1-CB 4.45Å; I269-D272 WeakPolarHBondContact O-CB 3.41Å; I269-D272 PolarHBondContact O-N 3.22Å; I269-D272 VanDerWaalsContact O-N 3.11Å; D272-W274 VanDerWaalsContact C-N 3.32Å; D272-W274 PolarHBondContact O-N 2.86Å; D272-A275 PolarHBondContact O-N 2.78Å; D272-F276 WeakPolarHBondContact O-CB 3.4Å; D272-F276 PolarHBondContact O-N 3.38Å; D272-F337 HydrophobicContact CB-CE2 3.95Å; D272-F337 HydrophobicContact CB-CZ 4.16Å
273	V	98.8	Very high	97.3	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.7	-42.9	171.7	169.2	0	0	0	0	111.2	I269 K270 A275 F276 G277 C326 R334 P335 F337 I340	I269-V273 WeakPolarHBondContact O-CG2 3.35Å; I269-V273 PolarHBondContact O-N 3.39Å; K270-V273 HydrophobicContact CD-CG2 4.47Å; V273-A275 PolarHBondContact O-N 3.36Å; V273-F276 WeakPolarHBondContact O-CB 3.39Å; V273-F276 PolarHBondContact O-N 2.75Å; V273-G277 PolarHBondContact O-N 3.48Å; V273-C326 HydrophobicContact CG1-CB 4.03Å; V273-C326 WeakPolarHBondContact O-CB 3.43Å; V273-R334 HydrophobicContact CG1-CB 3.95Å; V273-P335 HydrophobicContact CG1-CG 4.4Å; V273-P335 WeakPolarHBondContact CG2-O 3.28Å; V273-F337 HydrophobicContact CB-CZ 4.49Å; V273-F337 HydrophobicContact CG2-CD2 3.87Å; V273-F337 HydrophobicContact CG2-CE1 4.39Å; V273-F337 HydrophobicContact CG2-CE2 3.61Å; V273-F337 HydrophobicContact CG2-CG 4.36Å; V273-F337 HydrophobicContact CG2-CZ 3.91Å; V273-I340 HydrophobicContact CG1-CD1 3.92Å; V273-I340 HydrophobicContact CG2-CD1 4.22Å
274	W	98.9	Very high	97.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-58.4	-49	173.5	177.7	-76.8	0	0	0	111.6	A258 P259 K270 S271 D272 F276 G277 V278 L303 W327	A258-W274 HydrophobicContact CB-CB 3.77Å; A258-W274 HydrophobicContact CB-CD2 4.03Å; A258-W274 HydrophobicContact CB-CE3 4.48Å; A258-W274 HydrophobicContact CB-CG 3.67Å; P259-W274 HydrophobicContact CG-CE3 4.44Å; P259-W274 HydrophobicContact CG-CH2 3.67Å; P259-W274 HydrophobicContact CG-CZ2 4.19Å; P259-W274 HydrophobicContact CG-CZ3 3.8Å; K270-W274 PolarHBondContact O-N 3.07Å; S271-W274 WeakPolarHBondContact O-CB 3.43Å; S271-W274 PolarHBondContact O-N 3.29Å; D272-W274 VanDerWaalsContact C-N 3.32Å; D272-W274 PolarHBondContact O-N 2.86Å; W274-F276 VanDerWaalsContact C-N 3.28Å; W274-F276 PolarHBondContact O-N 3.28Å; W274-G277 PolarHBondContact O-N 3.1Å; W274-G277 VanDerWaalsContact O-N 3.08Å; W274-V278 PolarHBondContact O-N 3.29Å; W274-L303 HydrophobicContact CH2-CD1 4.11Å; W274-L303 HydrophobicContact CH2-CD2 3.92Å; W274-L303 HydrophobicContact CH2-CG 4.49Å; W274-L303 HydrophobicContact CZ2-CD1 3.67Å; W274-L303 HydrophobicContact CZ2-CD2 3.83Å; W274-L303 HydrophobicContact CZ2-CG 4.36Å; W274-W327 AromaticContact CD2-CD1 3.81Å; W274-W327 AromaticContact CE2-CD1 3.9Å; W274-W327 HydrophobicContact CE3-CB 4.18Å; W274-W327 HydrophobicContact CH2-CB 4.12Å; W274-W327 HydrophobicContact CZ3-CB 3.92Å; W274-W327 WeakPolarHBondContact CZ3-O 3.23Å; W274-W327 PolarHBondContact O-NE1 3.31Å
275	A	98.8	Very high	97.8	Very high	5 Å²	5	14.7 Å²	14.7	4%	0.041	8%	0.076	C	C	.	.	H	α-helix	trans	-60.9	-37.5	178.2	0	0	0	0	0	111.9	L215 S271 D272 V273 G277 V278 L279	L215-A275 HydrophobicContact CB-CB 4.06Å; S271-A275 PolarHBondContact O-N 2.78Å; S271-A275 VanDerWaalsContact O-N 3.14Å; D272-A275 PolarHBondContact O-N 2.78Å; V273-A275 PolarHBondContact O-N 3.36Å; A275-G277 VanDerWaalsContact C-N 3.35Å; A275-G277 PolarHBondContact O-N 2.86Å; A275-V278 WeakPolarHBondContact O-CB 3.46Å; A275-V278 PolarHBondContact O-N 2.81Å; A275-V278 VanDerWaalsContact O-N 3.16Å; A275-L279 PolarHBondContact O-N 3.2Å
276	F	98.9	Very high	98.1	Very high	3 Å²	3	14.9 Å²	14.9	1%	0.013	8%	0.075	C	C	.	.	H	α-helix	trans	-61.6	-39.9	172.8	-179.4	-102.7	0	0	0	112.3	I198 L215 D272 V273 W274 V278 L279 L280 F337 I340	I198-F276 HydrophobicContact CB-CE2 4.23Å; I198-F276 HydrophobicContact CG2-CD2 4.01Å; I198-F276 HydrophobicContact CG2-CE2 3.86Å; L215-F276 HydrophobicContact CD2-CB 3.79Å; L215-F276 HydrophobicContact CD2-CD2 4.22Å; D272-F276 WeakPolarHBondContact O-CB 3.4Å; D272-F276 PolarHBondContact O-N 3.38Å; V273-F276 WeakPolarHBondContact O-CB 3.39Å; V273-F276 PolarHBondContact O-N 2.75Å; W274-F276 VanDerWaalsContact C-N 3.28Å; W274-F276 PolarHBondContact O-N 3.28Å; F276-V278 VanDerWaalsContact C-N 3.3Å; F276-V278 PolarHBondContact O-N 2.94Å; F276-L279 HydrophobicContact CD2-CD2 4Å; F276-L279 HydrophobicContact CE2-CD2 4.06Å; F276-L279 CarbonylContact O-C 3.44Å; F276-L279 PolarHBondContact O-N 2.76Å; F276-L280 HydrophobicContact CD1-CD1 4.05Å; F276-L280 HydrophobicContact CD1-CG 4.09Å; F276-L280 HydrophobicContact CE1-CD1 3.48Å; F276-L280 VanDerWaalsContact CE1-CD1 3.48Å; F276-L280 HydrophobicContact CE1-CD2 4Å; F276-L280 HydrophobicContact CE1-CG 3.6Å; F276-L280 HydrophobicContact CE2-CD2 4.35Å; F276-L280 HydrophobicContact CE2-CG 4.41Å; F276-L280 HydrophobicContact CZ-CD1 4.09Å; F276-L280 HydrophobicContact CZ-CD2 3.7Å; F276-L280 HydrophobicContact CZ-CG 3.79Å; F276-L280 PolarHBondContact O-N 2.91Å; F276-F337 HydrophobicContact CB-CE1 3.7Å; F276-F337 HydrophobicContact CB-CZ 3.97Å; F276-F337 HydrophobicContact CD1-CE1 4.22Å; F276-F337 HydrophobicContact CD2-CE1 4.14Å; F276-F337 AromaticContact CG-CE1 3.76Å; F276-F337 HydrophobicContact CG-CE1 3.76Å; F276-I340 HydrophobicContact CD1-CD1 4.22Å; F276-I340 HydrophobicContact CD1-CG2 4Å; F276-I340 HydrophobicContact CE1-CG2 3.33Å; F276-I340 HydrophobicContact CZ-CG2 3.97Å
277	G	98.9	Very high	98.3	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-58	-42.1	172.4	0	0	0	0	0	112.5	V273 W274 A275 L280 W281 W327	V273-G277 PolarHBondContact O-N 3.48Å; W274-G277 PolarHBondContact O-N 3.1Å; W274-G277 VanDerWaalsContact O-N 3.08Å; A275-G277 VanDerWaalsContact C-N 3.35Å; A275-G277 PolarHBondContact O-N 2.86Å; G277-L280 PolarHBondContact O-N 3.47Å; G277-W281 PolarHBondContact O-N 2.78Å; G277-W327 WeakPolarHBondContact O-CZ2 3.45Å
278	V	98.9	Very high	98.5	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-65.8	-42.5	174.8	-176.6	0	0	0	0	111.1	W256 W274 A275 F276 L280 W281 E282 P290 M309 W327	W256-V278 HydrophobicContact CD2-CG1 4.33Å; W256-V278 HydrophobicContact CG-CB 4.43Å; W256-V278 HydrophobicContact CG-CG1 4.03Å; W274-V278 PolarHBondContact O-N 3.29Å; A275-V278 WeakPolarHBondContact O-CB 3.46Å; A275-V278 PolarHBondContact O-N 2.81Å; A275-V278 VanDerWaalsContact O-N 3.16Å; F276-V278 VanDerWaalsContact C-N 3.3Å; F276-V278 PolarHBondContact O-N 2.94Å; V278-L280 PolarHBondContact O-N 3.46Å; V278-W281 WeakPolarHBondContact O-CA 3.36Å; V278-W281 VanDerWaalsContact O-CB 3.31Å; V278-W281 WeakPolarHBondContact O-CB 3.41Å; V278-W281 PolarHBondContact O-N 2.67Å; V278-W281 VanDerWaalsContact O-N 3.1Å; V278-E282 PolarHBondContact O-N 2.96Å; V278-P290 HydrophobicContact CG1-CB 3.94Å; V278-P290 HydrophobicContact CG1-CG 3.7Å; V278-M309 HydrophobicContact CG1-CE 4.31Å; V278-M309 HydrophobicContact CG2-CE 4.44Å; V278-W327 HydrophobicContact CG2-CZ2 4.29Å
279	L	98.9	Very high	98.6	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-63	-38.2	175.7	174.3	147.4	0	0	0	112.6	I198 L215 A275 F276 W281 E282 I283	I198-L279 HydrophobicContact CD1-CD1 4.34Å; I198-L279 HydrophobicContact CD1-CD2 3.81Å; I198-L279 HydrophobicContact CG2-CD1 4.39Å; I198-L279 HydrophobicContact CG2-CD2 4.07Å; L215-L279 HydrophobicContact CD1-CD1 4.13Å; L215-L279 HydrophobicContact CG-CD1 4.15Å; A275-L279 PolarHBondContact O-N 3.2Å; F276-L279 HydrophobicContact CD2-CD2 4Å; F276-L279 HydrophobicContact CE2-CD2 4.06Å; F276-L279 CarbonylContact O-C 3.44Å; F276-L279 PolarHBondContact O-N 2.76Å; L279-W281 VanDerWaalsContact C-N 3.26Å; L279-W281 PolarHBondContact O-N 3.32Å; L279-E282 WeakPolarHBondContact CA-OE2 3.31Å; L279-E282 WeakPolarHBondContact O-CB 3.29Å; L279-E282 PolarHBondContact O-N 3.46Å; L279-I283 HydrophobicContact CD2-CD1 3.58Å; L279-I283 HydrophobicContact CD2-CG1 4.41Å; L279-I283 HydrophobicContact CG-CD1 4.36Å; L279-I283 WeakPolarHBondContact O-CG1 3.48Å; L279-I283 PolarHBondContact O-N 2.8Å
280	L	98.9	Very high	98.7	Very high	10 Å²	10	15.3 Å²	15.3	5%	0.052	9%	0.085	C	C	.	.	H	α-helix	trans	-60.6	-39.2	172.1	-78.6	-176.1	0	0	0	111.3	A195 F276 G277 V278 I283 A284 L322 M323	A195-L280 HydrophobicContact CB-CD2 3.64Å; F276-L280 HydrophobicContact CD1-CD1 4.05Å; F276-L280 HydrophobicContact CD1-CG 4.09Å; F276-L280 HydrophobicContact CE1-CD1 3.48Å; F276-L280 VanDerWaalsContact CE1-CD1 3.48Å; F276-L280 HydrophobicContact CE1-CD2 4Å; F276-L280 HydrophobicContact CE1-CG 3.6Å; F276-L280 HydrophobicContact CE2-CD2 4.35Å; F276-L280 HydrophobicContact CE2-CG 4.41Å; F276-L280 HydrophobicContact CZ-CD1 4.09Å; F276-L280 HydrophobicContact CZ-CD2 3.7Å; F276-L280 HydrophobicContact CZ-CG 3.79Å; F276-L280 PolarHBondContact O-N 2.91Å; G277-L280 PolarHBondContact O-N 3.47Å; V278-L280 PolarHBondContact O-N 3.46Å; L280-I283 PolarHBondContact O-N 2.97Å; L280-A284 VanDerWaalsContact O-CB 3.31Å; L280-A284 WeakPolarHBondContact O-CB 3.32Å; L280-A284 PolarHBondContact O-N 3.1Å; L280-L322 HydrophobicContact CD1-CD2 3.95Å; L280-L322 HydrophobicContact CD1-CG 4.16Å; L280-M323 HydrophobicContact CB-CE 4.03Å; L280-M323 HydrophobicContact CB-CG 3.97Å; L280-M323 HydrophobicContact CD1-CG 4.31Å; L280-M323 WeakPolarHBondContact O-CE 3.28Å
281	W	98.9	Very high	98.7	Very high	10 Å²	10	13.5 Å²	13.5	4%	0.038	8%	0.077	C	C	.	.	H	α-helix	trans	-65.9	-40.4	175	-170.2	98	0	0	0	111.6	G277 V278 L279 I283 A284 T285 M288 P290 M309 E310 P312 M323 W327	G277-W281 PolarHBondContact O-N 2.78Å; V278-W281 WeakPolarHBondContact O-CA 3.36Å; V278-W281 VanDerWaalsContact O-CB 3.31Å; V278-W281 WeakPolarHBondContact O-CB 3.41Å; V278-W281 PolarHBondContact O-N 2.67Å; V278-W281 VanDerWaalsContact O-N 3.1Å; L279-W281 VanDerWaalsContact C-N 3.26Å; L279-W281 PolarHBondContact O-N 3.32Å; W281-I283 PolarHBondContact O-N 3.18Å; W281-A284 PolarHBondContact O-N 3.22Å; W281-T285 HydrophobicContact CD2-CG2 3.88Å; W281-T285 HydrophobicContact CE3-CG2 3.96Å; W281-T285 HydrophobicContact CH2-CG2 3.84Å; W281-T285 HydrophobicContact CZ2-CG2 3.75Å; W281-T285 HydrophobicContact CZ3-CG2 3.93Å; W281-T285 WeakPolarHBondContact O-CB 2.93Å; W281-T285 VanDerWaalsContact O-CG2 3.3Å; W281-T285 WeakPolarHBondContact O-CG2 3.48Å; W281-T285 PolarHBondContact O-N 3.37Å; W281-T285 PolarHBondContact O-OG1 3.3Å; W281-M288 HydrophobicContact CH2-CB 3.84Å; W281-M288 HydrophobicContact CH2-CE 4.45Å; W281-M288 HydrophobicContact CZ3-CB 3.78Å; W281-P290 HydrophobicContact CE3-CB 4.48Å; W281-P290 HydrophobicContact CE3-CG 4.45Å; W281-P290 HydrophobicContact CZ3-CB 4.47Å; W281-M309 HydrophobicContact CB-CE 4.07Å; W281-M309 HydrophobicContact CD2-CE 4.06Å; W281-M309 HydrophobicContact CD2-SD 3.78Å; W281-M309 HydrophobicContact CE3-SD 4.14Å; W281-M309 HydrophobicContact CG-CE 3.84Å; W281-M309 HydrophobicContact CG-SD 4.14Å; W281-M309 HydrophobicContact CZ2-SD 4.19Å; W281-M309 HydrophobicContact CZ3-SD 4.5Å; W281-E310 PolarHBondContact NE1-O 3.21Å; W281-P312 HydrophobicContact CG-CG 4.23Å; W281-M323 HydrophobicContact CB-CE 4.36Å; W281-M323 HydrophobicContact CB-SD 3.92Å; W281-M323 HydrophobicContact CG-SD 4.41Å; W281-W327 HydrophobicContact CB-CH2 4.09Å; W281-W327 HydrophobicContact CB-CZ2 4.19Å; W281-W327 HydrophobicContact CG-CH2 4.32Å
282	E	98.9	Very high	98.7	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.009	10%	0.098	C	C	.	.	H	α-helix	trans	-59	-46.1	172.2	-65	179.8	92.6	0	0	111.5	A217 W256 V278 L279 T285 Y286 G287 P290	A217-E282 HydrophobicContact CB-CB 4.19Å; A217-E282 WeakPolarHBondContact CB-OE1 3.27Å; A217-E282 PolarHBondContact N-OE2 2.84Å; A217-E282 VanDerWaalsContact N-OE2 3.16Å; W256-E282 WeakPolarHBondContact CZ2-OE1 3.38Å; W256-E282 PolarHBondContact NE1-OE2 3.13Å; V278-E282 PolarHBondContact O-N 2.96Å; L279-E282 WeakPolarHBondContact CA-OE2 3.31Å; L279-E282 WeakPolarHBondContact O-CB 3.29Å; L279-E282 PolarHBondContact O-N 3.46Å; E282-T285 PolarHBondContact O-N 3.25Å; E282-T285 PolarHBondContact O-OG1 3.42Å; E282-T285 VanDerWaalsContact O-OG1 3.12Å; E282-Y286 PolarHBondContact O-N 3.26Å; E282-G287 PolarHBondContact O-N 2.77Å; E282-P290 HydrophobicContact CG-CG 4.11Å
283	I	98.9	Very high	98.6	Very high	5 Å²	5	21 Å²	21	3%	0.026	14%	0.143	C	C	.	.	H	α-helix	trans	-61.5	-48.1	177.6	-68.9	171.6	0	0	0	110.6	L174 L178 L191 A195 I198 L279 L280 W281 T285 Y286	L174-I283 HydrophobicContact CD2-CD1 4.17Å; L174-I283 HydrophobicContact CD2-CG1 4.12Å; L178-I283 HydrophobicContact CD1-CG1 4.21Å; L191-I283 HydrophobicContact CB-CG2 3.84Å; L191-I283 HydrophobicContact CD2-CG2 3.99Å; L191-I283 HydrophobicContact CG-CG2 4.36Å; A195-I283 HydrophobicContact CB-CD1 4.12Å; I198-I283 HydrophobicContact CD1-CD1 3.95Å; L279-I283 HydrophobicContact CD2-CD1 3.58Å; L279-I283 HydrophobicContact CD2-CG1 4.41Å; L279-I283 HydrophobicContact CG-CD1 4.36Å; L279-I283 WeakPolarHBondContact O-CG1 3.48Å; L279-I283 PolarHBondContact O-N 2.8Å; L280-I283 PolarHBondContact O-N 2.97Å; W281-I283 PolarHBondContact O-N 3.18Å; I283-T285 PolarHBondContact O-N 3.39Å; I283-Y286 PolarHBondContact O-N 2.75Å
284	A	98.7	Very high	98.5	Very high	24 Å²	24	22.6 Å²	22.6	20%	0.198	15%	0.15	C	C	.	.	H	α-helix	trans	-66.2	-21.9	-177.8	0	0	0	0	0	113.6	L280 W281 P312 M323	L280-A284 VanDerWaalsContact O-CB 3.31Å; L280-A284 WeakPolarHBondContact O-CB 3.32Å; L280-A284 PolarHBondContact O-N 3.1Å; W281-A284 PolarHBondContact O-N 3.22Å; A284-P312 HydrophobicContact CB-CB 4.19Å; A284-P312 HydrophobicContact CB-CG 3.93Å; A284-M323 HydrophobicContact CB-CE 3.8Å
285	T	98.8	Very high	98.4	Very high	13 Å²	13	27 Å²	27	8%	0.08	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	4.2	179.9	55.8	0	0	0	0	113.7	W281 E282 I283 G287 M288 P312	W281-T285 HydrophobicContact CD2-CG2 3.88Å; W281-T285 HydrophobicContact CE3-CG2 3.96Å; W281-T285 HydrophobicContact CH2-CG2 3.84Å; W281-T285 HydrophobicContact CZ2-CG2 3.75Å; W281-T285 HydrophobicContact CZ3-CG2 3.93Å; W281-T285 WeakPolarHBondContact O-CB 2.93Å; W281-T285 VanDerWaalsContact O-CG2 3.3Å; W281-T285 WeakPolarHBondContact O-CG2 3.48Å; W281-T285 PolarHBondContact O-N 3.37Å; W281-T285 PolarHBondContact O-OG1 3.3Å; E282-T285 PolarHBondContact O-N 3.25Å; E282-T285 PolarHBondContact O-OG1 3.42Å; E282-T285 VanDerWaalsContact O-OG1 3.12Å; I283-T285 PolarHBondContact O-N 3.39Å; T285-G287 VanDerWaalsContact C-N 3.3Å; T285-G287 PolarHBondContact O-N 2.97Å; T285-M288 HydrophobicContact CG2-CB 4.42Å; T285-M288 HydrophobicContact CG2-SD 4.09Å; T285-M288 PolarHBondContact OG1-N 3.43Å; T285-P312 HydrophobicContact CG2-CB 3.67Å; T285-P312 HydrophobicContact CG2-CG 3.7Å
286	Y	98.8	Very high	98.2	Very high	36 Å²	36	30.6 Å²	30.6	14%	0.141	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	42.9	-172	-67.3	-94.3	0	0	0	112.7	L178 R183 V186 L191 E282 I283	L178-Y286 HydrophobicContact CD2-CD1 4.39Å; R183-Y286 HydrophobicContact CB-CE1 4.07Å; R183-Y286 HydrophobicContact CG-CD1 3.87Å; R183-Y286 HydrophobicContact CG-CE1 3.69Å; R183-Y286 HydrophobicContact CG-CG 4.4Å; V186-Y286 HydrophobicContact CG1-CE1 4.39Å; V186-Y286 VanDerWaalsContact O-CE1 3.3Å; V186-Y286 WeakPolarHBondContact O-CE1 3.45Å; V186-Y286 PolarHBondContact O-OH 3.22Å; L191-Y286 HydrophobicContact CD1-CE1 4.3Å; L191-Y286 HydrophobicContact CD1-CE2 3.9Å; L191-Y286 HydrophobicContact CD2-CD1 4.49Å; L191-Y286 HydrophobicContact CD2-CE1 4.05Å; E282-Y286 PolarHBondContact O-N 3.26Å; I283-Y286 PolarHBondContact O-N 2.75Å
287	G	98.4	Very high	98	Very high	2 Å²	2	35.1 Å²	35.1	2%	0.021	22%	0.224	C	C	.	.	S	Bend	trans	85.6	27.6	170.4	0	0	0	0	0	115.4	R179 E282 T285	R179-G287 PolarHBondContact NE-O 3.43Å; R179-G287 PolarHBondContact NH2-O 3.49Å; E282-G287 PolarHBondContact O-N 2.77Å; T285-G287 VanDerWaalsContact C-N 3.3Å; T285-G287 PolarHBondContact O-N 2.97Å
288	M	98.6	Very high	97.9	Very high	97 Å²	97	39.8 Å²	39.8	48%	0.478	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-63.1	156.4	171.4	-72	178.2	63.4	0	0	111.4	W281 T285 P290	W281-M288 HydrophobicContact CH2-CB 3.84Å; W281-M288 HydrophobicContact CH2-CE 4.45Å; W281-M288 HydrophobicContact CZ3-CB 3.78Å; T285-M288 HydrophobicContact CG2-CB 4.42Å; T285-M288 HydrophobicContact CG2-SD 4.09Å; T285-M288 PolarHBondContact OG1-N 3.43Å; M288-P290 WeakPolarHBondContact O-CD 3.44Å
289	S	98.1	Very high	97.8	Very high	64 Å²	64	39.9 Å²	39.9	45%	0.448	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-71.7	127.6	171.9	-163.7	0	0	0	0	109.8	K255	K255-S289 PolarHBondContact NZ-OG 2.74Å
290	P	98.6	Very high	97.7	Very high	1 Å²	1	43 Å²	43	1%	0.006	26%	0.259	C	S	.	.	S	Bend	trans	-59.8	154.5	177.8	-25.1	34.6	0	0	0	112.6	K255 W256 V278 W281 E282 M288 M309	K255-P290 HydrophobicContact CB-CB 4.23Å; K255-P290 HydrophobicContact CD-CB 4.24Å; K255-P290 WeakPolarHBondContact CD-O 3.19Å; K255-P290 WeakPolarHBondContact CE-O 3.36Å; K255-P290 PolarHBondContact NZ-O 3.23Å; W256-P290 HydrophobicContact CH2-CG 4.16Å; W256-P290 HydrophobicContact CZ2-CG 3.75Å; V278-P290 HydrophobicContact CG1-CB 3.94Å; V278-P290 HydrophobicContact CG1-CG 3.7Å; W281-P290 HydrophobicContact CE3-CB 4.48Å; W281-P290 HydrophobicContact CE3-CG 4.45Å; W281-P290 HydrophobicContact CZ3-CB 4.47Å; E282-P290 HydrophobicContact CG-CG 4.11Å; M288-P290 WeakPolarHBondContact O-CD 3.44Å; P290-M309 HydrophobicContact CB-CE 4.24Å; P290-M309 HydrophobicContact CB-SD 3.8Å
291	Y	98.3	Very high	97.7	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.016	28%	0.278	C	S	.	.	S	Bend	trans	53.6	59	-178.5	-53.7	-89.1	0	0	0	112.5	K255 G293 I294 L303 Y307 M309	K255-Y291 HydrophobicContact CB-CD2 3.97Å; K255-Y291 HydrophobicContact CB-CE2 4.16Å; K255-Y291 HydrophobicContact CD-CD2 4.49Å; K255-Y291 HydrophobicContact CG-CD2 4.01Å; K255-Y291 VanDerWaalsContact O-CE2 3.27Å; K255-Y291 WeakPolarHBondContact O-CE2 3.48Å; Y291-G293 PolarHBondContact O-N 3.34Å; Y291-I294 HydrophobicContact CD1-CD1 4.34Å; Y291-I294 PolarHBondContact O-N 3.01Å; Y291-L303 HydrophobicContact CE1-CD2 4.19Å; Y291-Y307 HydrophobicContact CD1-CE1 4.01Å; Y291-Y307 HydrophobicContact CE1-CE1 4.32Å; Y291-M309 HydrophobicContact CD1-CG 3.74Å; Y291-M309 HydrophobicContact CD1-SD 4.31Å; Y291-M309 HydrophobicContact CD2-SD 4.05Å; Y291-M309 HydrophobicContact CE1-CG 3.83Å; Y291-M309 HydrophobicContact CE1-SD 4.42Å; Y291-M309 HydrophobicContact CE2-CE 4.09Å; Y291-M309 HydrophobicContact CE2-SD 4.13Å; Y291-M309 HydrophobicContact CG-CG 4.11Å; Y291-M309 HydrophobicContact CG-SD 4.12Å; Y291-M309 PolarHBondContact N-SD 3.44Å
292	P	97.8	Very high	97.6	Very high	74 Å²	74	48.9 Å²	48.9	48%	0.481	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	133.2	-179.2	27.2	-34.7	0	0	0	110.6	I294	P292-I294 VanDerWaalsContact C-N 3.29Å; P292-I294 PolarHBondContact O-N 3.11Å
293	G	96.9	Very high	97.6	Very high	92 Å²	92	48.9 Å²	48.9	95%	0.948	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	4.2	178.9	0	0	0	0	0	115.9	Y291	Y291-G293 PolarHBondContact O-N 3.34Å
294	I	97.7	Very high	97.5	Very high	32 Å²	32	54.1 Å²	54.1	16%	0.164	31%	0.312	C	S	.	.			trans	-108.6	131.8	179.7	-66.2	168.3	0	0	0	110.2	Y291 P292 Q298 V299 L302 Y307	Y291-I294 HydrophobicContact CD1-CD1 4.34Å; Y291-I294 PolarHBondContact O-N 3.01Å; P292-I294 VanDerWaalsContact C-N 3.29Å; P292-I294 PolarHBondContact O-N 3.11Å; I294-Q298 HydrophobicContact CG2-CB 4.45Å; I294-V299 HydrophobicContact CG2-CG2 3.98Å; I294-L302 HydrophobicContact CD1-CD1 3.85Å; I294-L302 HydrophobicContact CG1-CD1 4.08Å; I294-L302 HydrophobicContact CG2-CD1 3.63Å; I294-Y307 HydrophobicContact CD1-CD1 4.32Å; I294-Y307 HydrophobicContact CD1-CE1 3.38Å; I294-Y307 HydrophobicContact CD1-CE2 4.4Å; I294-Y307 VanDerWaalsContact CD1-CZ 3.43Å; I294-Y307 VanDerWaalsContact CD1-OH 3.24Å; I294-Y307 WeakPolarHBondContact CD1-OH 3.39Å
295	D	96.4	Very high	97.5	Very high	93 Å²	93	59.6 Å²	59.6	50%	0.497	33%	0.332	S	S	.	.			trans	-72.4	142.2	172.8	-172	-88.8	0	0	0	111.3	S297 Q298	D295-S297 PolarHBondContact O-N 2.89Å; D295-S297 VanDerWaalsContact O-N 3.16Å; D295-S297 VanDerWaalsContact OD1-CB 3.24Å; D295-S297 WeakPolarHBondContact OD1-CB 3.43Å; D295-S297 PolarHBondContact OD1-N 3.18Å; D295-S297 PolarHBondContact OD1-OG 2.81Å; D295-Q298 PolarHBondContact O-N 3.2Å
296	L	94.3	Very high	97.5	Very high	80 Å²	80	63.8 Å²	63.8	42%	0.419	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-58.1	-31.6	-177.8	-67.9	-179.3	0	0	0	113.1	I254 K255 Q298 V299	I254-L296 HydrophobicContact CB-CD2 4.3Å; I254-L296 HydrophobicContact CD1-CB 4.1Å; I254-L296 HydrophobicContact CD1-CD1 4.46Å; I254-L296 HydrophobicContact CG2-CD2 4.32Å; K255-L296 HydrophobicContact CD-CD2 4.11Å; K255-L296 VanDerWaalsContact CE-CD2 3.48Å; K255-L296 HydrophobicContact CG-CD2 3.63Å; L296-Q298 PolarHBondContact O-N 3.23Å; L296-V299 PolarHBondContact O-N 3.36Å
297	S	94.7	Very high	97.5	Very high	99 Å²	99	65.4 Å²	65.4	69%	0.692	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-67.4	-22.4	178.7	64.1	0	0	0	0	113.5	D295	D295-S297 PolarHBondContact O-N 2.89Å; D295-S297 VanDerWaalsContact O-N 3.16Å; D295-S297 VanDerWaalsContact OD1-CB 3.24Å; D295-S297 WeakPolarHBondContact OD1-CB 3.43Å; D295-S297 PolarHBondContact OD1-N 3.18Å; D295-S297 PolarHBondContact OD1-OG 2.81Å
298	Q	96.6	Very high	97.5	Very high	97 Å²	97	66.1 Å²	66.1	45%	0.453	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-96	-13.3	-176.5	-64.7	-180	-28	0	0	113.4	I294 D295 L296 Y300 E301 L302	I294-Q298 HydrophobicContact CG2-CB 4.45Å; D295-Q298 PolarHBondContact O-N 3.2Å; L296-Q298 PolarHBondContact O-N 3.23Å; Q298-Y300 PolarHBondContact O-N 2.98Å; Q298-E301 PolarHBondContact O-N 3.32Å; Q298-L302 HydrophobicContact CB-CD1 4.28Å; Q298-L302 WeakPolarHBondContact O-CG 3.17Å; Q298-L302 PolarHBondContact O-N 3.35Å
299	V	96.9	Very high	97.5	Very high	3 Å²	3	61.5 Å²	61.5	2%	0.018	34%	0.339	C	S	.	.	H	α-helix	trans	-54.7	-49.4	-172.4	172	0	0	0	0	111.4	I254 I294 L296 E301 L302 L303	I254-V299 HydrophobicContact CG2-CB 4.18Å; I254-V299 HydrophobicContact CG2-CG1 4.33Å; I254-V299 HydrophobicContact CG2-CG2 4.38Å; I294-V299 HydrophobicContact CG2-CG2 3.98Å; L296-V299 PolarHBondContact O-N 3.36Å; V299-E301 PolarHBondContact O-N 2.92Å; V299-L302 PolarHBondContact O-N 3.21Å; V299-L303 HydrophobicContact CG1-CD1 3.83Å; V299-L303 HydrophobicContact CG1-CG 4.27Å; V299-L303 VanDerWaalsContact O-CG 3.23Å; V299-L303 WeakPolarHBondContact O-CG 3.46Å; V299-L303 PolarHBondContact O-N 2.83Å
300	Y	96.9	Very high	97.5	Very high	64 Å²	64	66 Å²	66	25%	0.251	35%	0.353	S	S	.	.	H	α-helix	trans	-61.7	-47.3	-178.3	-176	-90.7	0	0	0	112.5	P259 L262 A263 Q298 L302 L303 E304 W329	P259-Y300 HydrophobicContact CB-CE2 4.16Å; L262-Y300 HydrophobicContact CB-CD2 3.9Å; L262-Y300 HydrophobicContact CB-CE2 4.38Å; L262-Y300 HydrophobicContact CD1-CD2 4.03Å; A263-Y300 HydrophobicContact CB-CE2 3.83Å; Q298-Y300 PolarHBondContact O-N 2.98Å; Y300-L302 VanDerWaalsContact C-N 3.29Å; Y300-L302 PolarHBondContact O-N 3.3Å; Y300-L303 PolarHBondContact O-N 2.95Å; Y300-E304 PolarHBondContact O-N 2.93Å; Y300-W329 HydrophobicContact CE2-CH2 4.32Å
301	E	97.7	Very high	97.5	Very high	97 Å²	97	71.3 Å²	71.3	45%	0.453	37%	0.373	S	S	.	.	H	α-helix	trans	-60.8	-39.6	-180	-171.8	-167.7	155.1	0	0	111.7	Q298 V299 E304 K305	Q298-E301 PolarHBondContact O-N 3.32Å; V299-E301 PolarHBondContact O-N 2.92Å; E301-E304 PolarHBondContact O-N 3.42Å; E301-K305 WeakPolarHBondContact O-CG 3.22Å; E301-K305 PolarHBondContact O-N 3.1Å; E301-K305 IonicContact OE1-NZ 3.19Å; E301-K305 PolarHBondContact OE1-NZ 2.67Å
302	L	98.3	Very high	97.5	Very high	48 Å²	48	71.6 Å²	71.6	25%	0.251	38%	0.375	S	S	.	.	H	α-helix	trans	-66.7	-46	176.1	-71.3	172.4	0	0	0	111.2	I294 Q298 V299 Y300 E304 K305 D306 Y307	I294-L302 HydrophobicContact CD1-CD1 3.85Å; I294-L302 HydrophobicContact CG1-CD1 4.08Å; I294-L302 HydrophobicContact CG2-CD1 3.63Å; Q298-L302 HydrophobicContact CB-CD1 4.28Å; Q298-L302 WeakPolarHBondContact O-CG 3.17Å; Q298-L302 PolarHBondContact O-N 3.35Å; V299-L302 PolarHBondContact O-N 3.21Å; Y300-L302 VanDerWaalsContact C-N 3.29Å; Y300-L302 PolarHBondContact O-N 3.3Å; L302-E304 PolarHBondContact O-N 3.04Å; L302-K305 CarbonylContact O-C 3.53Å; L302-K305 PolarHBondContact O-N 3.03Å; L302-D306 PolarHBondContact O-N 3.29Å; L302-Y307 HydrophobicContact CB-CD1 3.87Å; L302-Y307 HydrophobicContact CB-CG 4.18Å; L302-Y307 HydrophobicContact CD1-CD1 4.48Å; L302-Y307 VanDerWaalsContact O-CB 3.27Å; L302-Y307 WeakPolarHBondContact O-CB 3.17Å; L302-Y307 PolarHBondContact O-N 2.86Å
303	L	98.3	Very high	97.5	Very high	1 Å²	1	77.4 Å²	77.4	1%	0.005	40%	0.396	C	S	.	.	H	α-helix	trans	-59.3	-38.1	177.9	-68.7	174.9	0	0	0	111.9	P259 W274 Y291 V299 Y300 K305 D306 Y307 R308 W329	P259-L303 HydrophobicContact CG-CD1 4.43Å; W274-L303 HydrophobicContact CH2-CD1 4.11Å; W274-L303 HydrophobicContact CH2-CD2 3.92Å; W274-L303 HydrophobicContact CH2-CG 4.49Å; W274-L303 HydrophobicContact CZ2-CD1 3.67Å; W274-L303 HydrophobicContact CZ2-CD2 3.83Å; W274-L303 HydrophobicContact CZ2-CG 4.36Å; Y291-L303 HydrophobicContact CE1-CD2 4.19Å; V299-L303 HydrophobicContact CG1-CD1 3.83Å; V299-L303 HydrophobicContact CG1-CG 4.27Å; V299-L303 VanDerWaalsContact O-CG 3.23Å; V299-L303 WeakPolarHBondContact O-CG 3.46Å; V299-L303 PolarHBondContact O-N 2.83Å; Y300-L303 PolarHBondContact O-N 2.95Å; L303-K305 VanDerWaalsContact C-N 3.27Å; L303-K305 PolarHBondContact O-N 2.78Å; L303-D306 WeakPolarHBondContact O-CA 3.08Å; L303-D306 PolarHBondContact O-N 2.9Å; L303-D306 VanDerWaalsContact O-N 3.08Å; L303-Y307 WeakPolarHBondContact CD2-O 3.45Å; L303-R308 PolarHBondContact O-NH1 2.88Å; L303-W329 VanDerWaalsContact C-CZ3 3.49Å; L303-W329 HydrophobicContact CB-CZ3 4.11Å
304	E	97.8	Very high	97.4	Very high	115 Å²	115	76.4 Å²	76.4	54%	0.537	39%	0.386	S	S	.	.	H	α-helix	trans	-64	-32.2	176.7	-171	176	-134.8	0	0	112.3	Y300 E301 L302 D306 W329	Y300-E304 PolarHBondContact O-N 2.93Å; E301-E304 PolarHBondContact O-N 3.42Å; L302-E304 PolarHBondContact O-N 3.04Å; E304-D306 PolarHBondContact O-N 2.7Å; E304-W329 HydrophobicContact CB-CH2 3.65Å; E304-W329 HydrophobicContact CB-CZ3 3.98Å; E304-W329 HydrophobicContact CG-CH2 3.88Å; E304-W329 HydrophobicContact CG-CZ2 4.28Å
305	K	98.1	Very high	97.4	Very high	139 Å²	139	75.3 Å²	75.3	60%	0.604	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	18.4	173.5	-66.4	170.6	179	171.5	0	113.4	E301 L302 L303 Y307	E301-K305 WeakPolarHBondContact O-CG 3.22Å; E301-K305 PolarHBondContact O-N 3.1Å; E301-K305 IonicContact OE1-NZ 3.19Å; E301-K305 PolarHBondContact OE1-NZ 2.67Å; L302-K305 CarbonylContact O-C 3.53Å; L302-K305 PolarHBondContact O-N 3.03Å; L303-K305 VanDerWaalsContact C-N 3.27Å; L303-K305 PolarHBondContact O-N 2.78Å; K305-Y307 PolarHBondContact O-N 3.02Å
306	D	98.1	Very high	97.5	Very high	101 Å²	101	74.8 Å²	74.8	54%	0.54	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	16.8	-178.3	-157.4	42.5	0	0	0	115.5	L302 L303 E304 R308	L302-D306 PolarHBondContact O-N 3.29Å; L303-D306 WeakPolarHBondContact O-CA 3.08Å; L303-D306 PolarHBondContact O-N 2.9Å; L303-D306 VanDerWaalsContact O-N 3.08Å; E304-D306 PolarHBondContact O-N 2.7Å; D306-R308 PolarHBondContact O-N 2.88Å; D306-R308 IonicContact OD1-CZ 2.93Å; D306-R308 IonicContact OD1-NH1 3.98Å; D306-R308 IonicContact OD1-NH2 3.68Å
307	Y	98.4	Very high	97.7	Very high	70 Å²	70	75.6 Å²	75.6	28%	0.275	38%	0.384	S	S	.	.			trans	-65	138	169.1	167.7	-91.2	0	0	0	110	Y291 I294 L302 L303 K305	Y291-Y307 HydrophobicContact CD1-CE1 4.01Å; Y291-Y307 HydrophobicContact CE1-CE1 4.32Å; I294-Y307 HydrophobicContact CD1-CD1 4.32Å; I294-Y307 HydrophobicContact CD1-CE1 3.38Å; I294-Y307 HydrophobicContact CD1-CE2 4.4Å; I294-Y307 VanDerWaalsContact CD1-CZ 3.43Å; I294-Y307 VanDerWaalsContact CD1-OH 3.24Å; I294-Y307 WeakPolarHBondContact CD1-OH 3.39Å; L302-Y307 HydrophobicContact CB-CD1 3.87Å; L302-Y307 HydrophobicContact CB-CG 4.18Å; L302-Y307 HydrophobicContact CD1-CD1 4.48Å; L302-Y307 VanDerWaalsContact O-CB 3.27Å; L302-Y307 WeakPolarHBondContact O-CB 3.17Å; L302-Y307 PolarHBondContact O-N 2.86Å; L303-Y307 WeakPolarHBondContact CD2-O 3.45Å; K305-Y307 PolarHBondContact O-N 3.02Å
308	R	98.5	Very high	97.9	Very high	17 Å²	17	79 Å²	79	6%	0.064	39%	0.387	C	S	.	.			trans	-137.1	157.5	170.8	-62	-63.7	-179.5	-81.6	-7.2	108.9	L303 D306 W327	L303-R308 PolarHBondContact O-NH1 2.88Å; D306-R308 PolarHBondContact O-N 2.88Å; D306-R308 IonicContact OD1-CZ 2.93Å; D306-R308 IonicContact OD1-NH1 3.98Å; D306-R308 IonicContact OD1-NH2 3.68Å; R308-W327 HydrophobicContact CB-CE3 4.2Å; R308-W327 HydrophobicContact CG-CE3 4.49Å; R308-W327 PolarHBondContact NE-O 2.81Å; R308-W327 PolarHBondContact NH2-O 3.05Å
309	M	98.7	Very high	98	Very high	1 Å²	1	76.7 Å²	76.7	1%	0.005	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-56.9	142.4	175.7	-68.6	-176.5	-73.2	0	0	111	V278 W281 P290 Y291 Y320 W327	V278-M309 HydrophobicContact CG1-CE 4.31Å; V278-M309 HydrophobicContact CG2-CE 4.44Å; W281-M309 HydrophobicContact CB-CE 4.07Å; W281-M309 HydrophobicContact CD2-CE 4.06Å; W281-M309 HydrophobicContact CD2-SD 3.78Å; W281-M309 HydrophobicContact CE3-SD 4.14Å; W281-M309 HydrophobicContact CG-CE 3.84Å; W281-M309 HydrophobicContact CG-SD 4.14Å; W281-M309 HydrophobicContact CZ2-SD 4.19Å; W281-M309 HydrophobicContact CZ3-SD 4.5Å; P290-M309 HydrophobicContact CB-CE 4.24Å; P290-M309 HydrophobicContact CB-SD 3.8Å; Y291-M309 HydrophobicContact CD1-CG 3.74Å; Y291-M309 HydrophobicContact CD1-SD 4.31Å; Y291-M309 HydrophobicContact CD2-SD 4.05Å; Y291-M309 HydrophobicContact CE1-CG 3.83Å; Y291-M309 HydrophobicContact CE1-SD 4.42Å; Y291-M309 HydrophobicContact CE2-CE 4.09Å; Y291-M309 HydrophobicContact CE2-SD 4.13Å; Y291-M309 HydrophobicContact CG-CG 4.11Å; Y291-M309 HydrophobicContact CG-SD 4.12Å; Y291-M309 PolarHBondContact N-SD 3.44Å; M309-Y320 WeakPolarHBondContact O-CE2 3.35Å; M309-Y320 PolarHBondContact O-OH 3.49Å; M309-W327 HydrophobicContact CB-CH2 4.33Å; M309-W327 HydrophobicContact CB-CZ3 4.45Å; M309-W327 HydrophobicContact CE-CH2 3.6Å; M309-W327 HydrophobicContact CE-CZ2 3.49Å; M309-W327 VanDerWaalsContact CE-CZ2 3.49Å
310	E	98.5	Very high	98.1	Very high	157 Å²	157	77.7 Å²	77.7	73%	0.734	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-64.4	157.6	176	-63.6	-176	-179.6	0	0	112	W281 P312	W281-E310 PolarHBondContact NE1-O 3.21Å; E310-P312 WeakPolarHBondContact O-CD 3.42Å
311	R	98.7	Very high	98.2	Very high	113 Å²	113	79.9 Å²	79.9	43%	0.426	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-62.7	124.1	175	-177.1	168.1	65.2	67.6	12.2	109.6	C315 E317 Y320	R311-C315 HydrophobicContact CG-CB 3.97Å; R311-C315 PolarHBondContact NH1-O 3.29Å; R311-E317 WeakPolarHBondContact CD-OE2 3.49Å; R311-E317 IonicContact NE-OE2 3.71Å; R311-E317 PolarHBondContact NE-OE2 2.97Å; R311-Y320 HydrophobicContact CB-CD1 3.81Å; R311-Y320 HydrophobicContact CB-CD2 3.77Å; R311-Y320 HydrophobicContact CB-CE1 4.01Å; R311-Y320 HydrophobicContact CB-CE2 3.98Å; R311-Y320 HydrophobicContact CB-CG 3.68Å; R311-Y320 HydrophobicContact CG-CD1 4.13Å; R311-Y320 HydrophobicContact CG-CD2 4.02Å; R311-Y320 HydrophobicContact CG-CG 3.7Å
312	P	98.6	Very high	98.2	Very high	10 Å²	10	77.7 Å²	77.7	7%	0.065	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-57.2	149.9	176.1	-26.1	35.1	0	0	0	112.7	W281 A284 T285 E310 G314 C315	W281-P312 HydrophobicContact CG-CG 4.23Å; A284-P312 HydrophobicContact CB-CB 4.19Å; A284-P312 HydrophobicContact CB-CG 3.93Å; T285-P312 HydrophobicContact CG2-CB 3.67Å; T285-P312 HydrophobicContact CG2-CG 3.7Å; E310-P312 WeakPolarHBondContact O-CD 3.42Å; P312-G314 PolarHBondContact O-N 3.07Å; P312-C315 HydrophobicContact CB-CB 3.95Å; P312-C315 HydrophobicContact CG-CB 4.33Å; P312-C315 WeakPolarHBondContact O-CB 3.48Å; P312-C315 PolarHBondContact O-N 3.36Å
313	E	97.3	Very high	98.3	Very high	196 Å²	196	75.4 Å²	75.4	92%	0.916	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	131.4	176.2	-170.2	-176.1	169.1	0	0	111	C315	E313-C315 PolarHBondContact O-N 2.92Å; E313-C315 VanDerWaalsContact O-N 3.09Å
314	G	95.4	Very high	98.3	Very high	71 Å²	71	79.8 Å²	79.8	73%	0.732	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	-2.6	-179.1	0	0	0	0	0	115.8	P312	P312-G314 PolarHBondContact O-N 3.07Å
315	C	98.2	Very high	98.3	Very high	10 Å²	10	75.9 Å²	75.9	7%	0.068	38%	0.378	C	S	.	.			trans	-67.3	126.8	177.4	-175.7	0	0	0	0	110.7	R311 P312 E313	R311-C315 HydrophobicContact CG-CB 3.97Å; R311-C315 PolarHBondContact NH1-O 3.29Å; P312-C315 HydrophobicContact CB-CB 3.95Å; P312-C315 HydrophobicContact CG-CB 4.33Å; P312-C315 WeakPolarHBondContact O-CB 3.48Å; P312-C315 PolarHBondContact O-N 3.36Å; E313-C315 PolarHBondContact O-N 2.92Å; E313-C315 VanDerWaalsContact O-N 3.09Å
316	P	98.1	Very high	98.4	Very high	81 Å²	81	69.2 Å²	69.2	53%	0.526	35%	0.349	S	S	.	.			trans	-62.2	141.4	175.6	-21.3	32.7	0	0	0	111.8	K318 V319 Y320	P316-K318 VanDerWaalsContact C-N 3.3Å; P316-K318 PolarHBondContact O-N 2.82Å; P316-V319 HydrophobicContact CB-CG2 4.2Å; P316-V319 HydrophobicContact CG-CG2 4.29Å; P316-V319 WeakPolarHBondContact O-CB 3.17Å; P316-V319 PolarHBondContact O-N 3.21Å; P316-Y320 PolarHBondContact O-N 3.17Å
317	E	98.3	Very high	98.4	Very high	98 Å²	98	64.5 Å²	64.5	46%	0.458	32%	0.324	S	S	.	.	H	α-helix	trans	-53.4	-45.2	-175.9	-168.6	59.4	-150	0	0	112.6	R311 V319 Y320 E321	R311-E317 WeakPolarHBondContact CD-OE2 3.49Å; R311-E317 IonicContact NE-OE2 3.71Å; R311-E317 PolarHBondContact NE-OE2 2.97Å; E317-V319 PolarHBondContact O-N 2.86Å; E317-V319 VanDerWaalsContact O-N 3.17Å; E317-Y320 CarbonylContact O-C 3.58Å; E317-Y320 WeakPolarHBondContact O-CA 3.39Å; E317-Y320 WeakPolarHBondContact O-CB 3.49Å; E317-Y320 PolarHBondContact O-N 3.24Å; E317-E321 HydrophobicContact CG-CG 4.31Å; E317-E321 WeakPolarHBondContact O-CG 3.47Å; E317-E321 PolarHBondContact O-N 2.96Å
318	K	98.4	Very high	98.4	Very high	170 Å²	170	64.9 Å²	64.9	74%	0.739	33%	0.328	S	S	*	.	H	α-helix	trans	-57.7	-33	178.4	-67.2	-170.4	174	-170.8	0	114.2	P316 L322	P316-K318 VanDerWaalsContact C-N 3.3Å; P316-K318 PolarHBondContact O-N 2.82Å; K318-L322 PolarHBondContact O-N 2.93Å; K318-L322 VanDerWaalsContact O-N 3.16Å
319	V	98.6	Very high	98.4	Very high	48 Å²	48	68.2 Å²	68.2	29%	0.291	34%	0.341	S	S	.	.	H	α-helix	trans	-73.5	-38	177.6	-178.5	0	0	0	0	109.5	P316 E317 L322 M323	P316-V319 HydrophobicContact CB-CG2 4.2Å; P316-V319 HydrophobicContact CG-CG2 4.29Å; P316-V319 WeakPolarHBondContact O-CB 3.17Å; P316-V319 PolarHBondContact O-N 3.21Å; E317-V319 PolarHBondContact O-N 2.86Å; E317-V319 VanDerWaalsContact O-N 3.17Å; V319-L322 WeakPolarHBondContact O-CB 3.45Å; V319-L322 PolarHBondContact O-N 3.03Å; V319-M323 HydrophobicContact CG1-CE 4.05Å; V319-M323 WeakPolarHBondContact O-CG 3.33Å; V319-M323 PolarHBondContact O-N 3.18Å; V319-M323 VanDerWaalsContact O-N 3.09Å
320	Y	98.8	Very high	98.4	Very high	25 Å²	25	72 Å²	72	10%	0.098	36%	0.361	C	S	.	.	H	α-helix	trans	-70.5	-38.7	175.4	-175.1	-114.8	0	0	0	112.8	M309 R311 P316 E317 L322 M323 R324 W327	M309-Y320 WeakPolarHBondContact O-CE2 3.35Å; M309-Y320 PolarHBondContact O-OH 3.49Å; R311-Y320 HydrophobicContact CB-CD1 3.81Å; R311-Y320 HydrophobicContact CB-CD2 3.77Å; R311-Y320 HydrophobicContact CB-CE1 4.01Å; R311-Y320 HydrophobicContact CB-CE2 3.98Å; R311-Y320 HydrophobicContact CB-CG 3.68Å; R311-Y320 HydrophobicContact CG-CD1 4.13Å; R311-Y320 HydrophobicContact CG-CD2 4.02Å; R311-Y320 HydrophobicContact CG-CG 3.7Å; P316-Y320 PolarHBondContact O-N 3.17Å; E317-Y320 CarbonylContact O-C 3.58Å; E317-Y320 WeakPolarHBondContact O-CA 3.39Å; E317-Y320 WeakPolarHBondContact O-CB 3.49Å; E317-Y320 PolarHBondContact O-N 3.24Å; Y320-L322 VanDerWaalsContact C-N 3.25Å; Y320-L322 PolarHBondContact O-N 3.12Å; Y320-M323 HydrophobicContact CD2-SD 4.02Å; Y320-M323 WeakPolarHBondContact O-CB 3.39Å; Y320-M323 PolarHBondContact O-N 3.44Å; Y320-M323 VanDerWaalsContact O-N 3.09Å; Y320-R324 HydrophobicContact CD1-CG 4.21Å; Y320-R324 HydrophobicContact CE1-CG 3.86Å; Y320-R324 HydrophobicContact CE2-CG 4.43Å; Y320-R324 WeakPolarHBondContact O-CG 3.4Å; Y320-R324 PolarHBondContact O-N 3.11Å; Y320-W327 HydrophobicContact CE2-CZ3 4.36Å
321	E	98.8	Very high	98.4	Very high	109 Å²	109	66.4 Å²	66.4	51%	0.509	34%	0.338	S	S	.	.	H	α-helix	trans	-56.2	-41.5	170.8	-72.6	174.5	167.7	0	0	111.1	E317 R324 A325	E317-E321 HydrophobicContact CG-CG 4.31Å; E317-E321 WeakPolarHBondContact O-CG 3.47Å; E317-E321 PolarHBondContact O-N 2.96Å; E321-R324 WeakPolarHBondContact O-CB 3.38Å; E321-R324 PolarHBondContact O-N 2.55Å; E321-A325 PolarHBondContact O-N 3.04Å
322	L	98.9	Very high	98.4	Very high	51 Å²	51	65.7 Å²	65.7	27%	0.267	35%	0.351	S	S	.	.	H	α-helix	trans	-62.8	-43.5	173.4	-177.2	61.4	0	0	0	112.2	L280 K318 V319 Y320 R324 A325 C326 I340	L280-L322 HydrophobicContact CD1-CD2 3.95Å; L280-L322 HydrophobicContact CD1-CG 4.16Å; K318-L322 PolarHBondContact O-N 2.93Å; K318-L322 VanDerWaalsContact O-N 3.16Å; V319-L322 WeakPolarHBondContact O-CB 3.45Å; V319-L322 PolarHBondContact O-N 3.03Å; Y320-L322 VanDerWaalsContact C-N 3.25Å; Y320-L322 PolarHBondContact O-N 3.12Å; L322-R324 VanDerWaalsContact C-N 3.31Å; L322-R324 PolarHBondContact O-N 3.04Å; L322-A325 WeakPolarHBondContact O-CB 3.43Å; L322-A325 PolarHBondContact O-N 2.9Å; L322-C326 PolarHBondContact O-N 3.01Å; L322-C326 PolarHBondContact O-SG 2.84Å; L322-C326 VanDerWaalsContact O-SG 3.34Å; L322-I340 HydrophobicContact CD1-CG1 4.18Å; L322-I340 HydrophobicContact CD2-CG2 4.38Å
323	M	98.9	Very high	98.4	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-58.5	-44.4	173.4	-62	177.4	-165.1	0	0	111.3	L280 W281 A284 V319 Y320 A325 C326 W327	L280-M323 HydrophobicContact CB-CE 4.03Å; L280-M323 HydrophobicContact CB-CG 3.97Å; L280-M323 HydrophobicContact CD1-CG 4.31Å; L280-M323 WeakPolarHBondContact O-CE 3.28Å; W281-M323 HydrophobicContact CB-CE 4.36Å; W281-M323 HydrophobicContact CB-SD 3.92Å; W281-M323 HydrophobicContact CG-SD 4.41Å; A284-M323 HydrophobicContact CB-CE 3.8Å; V319-M323 HydrophobicContact CG1-CE 4.05Å; V319-M323 WeakPolarHBondContact O-CG 3.33Å; V319-M323 PolarHBondContact O-N 3.18Å; V319-M323 VanDerWaalsContact O-N 3.09Å; Y320-M323 HydrophobicContact CD2-SD 4.02Å; Y320-M323 WeakPolarHBondContact O-CB 3.39Å; Y320-M323 PolarHBondContact O-N 3.44Å; Y320-M323 VanDerWaalsContact O-N 3.09Å; M323-A325 VanDerWaalsContact C-N 3.32Å; M323-A325 PolarHBondContact O-N 2.78Å; M323-C326 WeakPolarHBondContact O-CB 3.41Å; M323-C326 PolarHBondContact O-N 3.21Å; M323-W327 HydrophobicContact CB-CE3 4.14Å; M323-W327 HydrophobicContact CB-CH2 3.76Å; M323-W327 HydrophobicContact CB-CZ2 4.15Å; M323-W327 HydrophobicContact CB-CZ3 3.76Å; M323-W327 HydrophobicContact CG-CH2 4.3Å; M323-W327 VanDerWaalsContact O-CD2 3.25Å; M323-W327 VanDerWaalsContact O-CG 3.32Å; M323-W327 PolarHBondContact O-N 2.93Å; M323-W327 HydrophobicContact SD-CH2 4Å
324	R	98.8	Very high	98.4	Very high	94 Å²	94	60.2 Å²	60.2	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-34.4	177.6	-71.5	-71.4	-58.7	-100	2.5	112.7	Y320 E321 L322 W327 Q328	Y320-R324 HydrophobicContact CD1-CG 4.21Å; Y320-R324 HydrophobicContact CE1-CG 3.86Å; Y320-R324 HydrophobicContact CE2-CG 4.43Å; Y320-R324 WeakPolarHBondContact O-CG 3.4Å; Y320-R324 PolarHBondContact O-N 3.11Å; E321-R324 WeakPolarHBondContact O-CB 3.38Å; E321-R324 PolarHBondContact O-N 2.55Å; L322-R324 VanDerWaalsContact C-N 3.31Å; L322-R324 PolarHBondContact O-N 3.04Å; R324-W327 CarbonylContact O-C 3.55Å; R324-W327 PolarHBondContact O-N 3.47Å; R324-Q328 PolarHBondContact O-N 2.65Å; R324-Q328 PolarHBondContact O-NE2 3.05Å; R324-Q328 VanDerWaalsContact O-NE2 3.1Å
325	A	98.9	Very high	98.6	Very high	32 Å²	32	57.9 Å²	57.9	26%	0.264	30%	0.299	S	S	.	.	H	α-helix	trans	-67.4	-40.8	172.6	0	0	0	0	0	111.3	E321 L322 M323 W327 Q328 P335	E321-A325 PolarHBondContact O-N 3.04Å; L322-A325 WeakPolarHBondContact O-CB 3.43Å; L322-A325 PolarHBondContact O-N 2.9Å; M323-A325 VanDerWaalsContact C-N 3.32Å; M323-A325 PolarHBondContact O-N 2.78Å; A325-W327 VanDerWaalsContact C-N 3.26Å; A325-W327 PolarHBondContact O-N 2.87Å; A325-Q328 WeakPolarHBondContact O-CG 3.49Å; A325-Q328 PolarHBondContact O-N 3.35Å; A325-P335 HydrophobicContact CB-CG 4.23Å; A325-P335 WeakPolarHBondContact O-CD 3.32Å
326	C	98.9	Very high	98.6	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-63.9	-31	173.5	-66.3	0	0	0	0	113	V273 L322 M323 R334	V273-C326 HydrophobicContact CG1-CB 4.03Å; V273-C326 WeakPolarHBondContact O-CB 3.43Å; L322-C326 PolarHBondContact O-N 3.01Å; L322-C326 PolarHBondContact O-SG 2.84Å; L322-C326 VanDerWaalsContact O-SG 3.34Å; M323-C326 WeakPolarHBondContact O-CB 3.41Å; M323-C326 PolarHBondContact O-N 3.21Å; C326-R334 VanDerWaalsContact O-CD 3.32Å; C326-R334 WeakPolarHBondContact O-CD 3.36Å
327	W	98.8	Very high	98.6	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.008	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	24	-179.2	-54.6	-37.2	0	0	0	114.8	W274 G277 V278 W281 R308 M309 Y320 M323 R324 A325	W274-W327 AromaticContact CD2-CD1 3.81Å; W274-W327 AromaticContact CE2-CD1 3.9Å; W274-W327 HydrophobicContact CE3-CB 4.18Å; W274-W327 HydrophobicContact CH2-CB 4.12Å; W274-W327 HydrophobicContact CZ3-CB 3.92Å; W274-W327 WeakPolarHBondContact CZ3-O 3.23Å; W274-W327 PolarHBondContact O-NE1 3.31Å; G277-W327 WeakPolarHBondContact O-CZ2 3.45Å; V278-W327 HydrophobicContact CG2-CZ2 4.29Å; W281-W327 HydrophobicContact CB-CH2 4.09Å; W281-W327 HydrophobicContact CB-CZ2 4.19Å; W281-W327 HydrophobicContact CG-CH2 4.32Å; R308-W327 HydrophobicContact CB-CE3 4.2Å; R308-W327 HydrophobicContact CG-CE3 4.49Å; R308-W327 PolarHBondContact NE-O 2.81Å; R308-W327 PolarHBondContact NH2-O 3.05Å; M309-W327 HydrophobicContact CB-CH2 4.33Å; M309-W327 HydrophobicContact CB-CZ3 4.45Å; M309-W327 HydrophobicContact CE-CH2 3.6Å; M309-W327 HydrophobicContact CE-CZ2 3.49Å; M309-W327 VanDerWaalsContact CE-CZ2 3.49Å; Y320-W327 HydrophobicContact CE2-CZ3 4.36Å; M323-W327 HydrophobicContact CB-CE3 4.14Å; M323-W327 HydrophobicContact CB-CH2 3.76Å; M323-W327 HydrophobicContact CB-CZ2 4.15Å; M323-W327 HydrophobicContact CB-CZ3 3.76Å; M323-W327 HydrophobicContact CG-CH2 4.3Å; M323-W327 VanDerWaalsContact O-CD2 3.25Å; M323-W327 VanDerWaalsContact O-CG 3.32Å; M323-W327 PolarHBondContact O-N 2.93Å; M323-W327 HydrophobicContact SD-CH2 4Å; R324-W327 CarbonylContact O-C 3.55Å; R324-W327 PolarHBondContact O-N 3.47Å; A325-W327 VanDerWaalsContact C-N 3.26Å; A325-W327 PolarHBondContact O-N 2.87Å
328	Q	98.9	Very high	98.6	Very high	78 Å²	78	52.7 Å²	52.7	36%	0.364	28%	0.279	S	S	.	.			trans	-59.7	139.4	166.8	-69.1	-57.8	-54.9	0	0	110.2	R324 A325 D333 R334	R324-Q328 PolarHBondContact O-N 2.65Å; R324-Q328 PolarHBondContact O-NE2 3.05Å; R324-Q328 VanDerWaalsContact O-NE2 3.1Å; A325-Q328 WeakPolarHBondContact O-CG 3.49Å; A325-Q328 PolarHBondContact O-N 3.35Å; Q328-D333 HydrophobicContact CB-CB 3.95Å; Q328-D333 HydrophobicContact CG-CB 4.23Å; Q328-R334 HydrophobicContact CB-CG 3.94Å; Q328-R334 PolarHBondContact O-NE 2.84Å; Q328-R334 PolarHBondContact O-NH2 2.89Å
329	W	98.6	Very high	98.6	Very high	86 Å²	86	51.3 Å²	51.3	33%	0.326	28%	0.275	S	S	.	.	S	Bend	trans	-60.8	-54.5	-175.8	-180	-95.5	0	0	0	111.1	P259 Y300 L303 E304 R334	P259-W329 HydrophobicContact CB-CE3 4.07Å; P259-W329 HydrophobicContact CB-CH2 3.91Å; P259-W329 HydrophobicContact CB-CZ2 4.37Å; P259-W329 HydrophobicContact CB-CZ3 3.72Å; P259-W329 HydrophobicContact CG-CE3 3.87Å; P259-W329 HydrophobicContact CG-CH2 4.5Å; P259-W329 HydrophobicContact CG-CZ3 3.81Å; Y300-W329 HydrophobicContact CE2-CH2 4.32Å; L303-W329 VanDerWaalsContact C-CZ3 3.49Å; L303-W329 HydrophobicContact CB-CZ3 4.11Å; E304-W329 HydrophobicContact CB-CH2 3.65Å; E304-W329 HydrophobicContact CB-CZ3 3.98Å; E304-W329 HydrophobicContact CG-CH2 3.88Å; E304-W329 HydrophobicContact CG-CZ2 4.28Å; W329-R334 PolarHBondContact O-NH2 3.43Å
330	N	98.4	Very high	98.5	Very high	81 Å²	81	51.4 Å²	51.4	43%	0.433	27%	0.273	S	S	.	.	S	Bend	trans	-74	130.9	176.9	-56.2	-47.6	0	0	0	110.1	S332 D333	N330-S332 PolarHBondContact O-N 2.96Å; N330-D333 HydrophobicContact CB-CB 4.4Å; N330-D333 WeakPolarHBondContact CB-OD2 3.34Å; N330-D333 PolarHBondContact ND2-OD2 3.16Å; N330-D333 PolarHBondContact O-N 3.17Å; N330-D333 VanDerWaalsContact O-N 3.13Å
331	P	98.3	Very high	98.5	Very high	40 Å²	40	52.7 Å²	52.7	26%	0.26	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-59.4	-32	179.3	-25.5	34.5	0	0	0	114.4	E260 K270 D333 R334	E260-P331 HydrophobicContact CG-CG 3.98Å; K270-P331 HydrophobicContact CB-CB 3.72Å; K270-P331 WeakPolarHBondContact CD-O 2.91Å; K270-P331 HydrophobicContact CG-CB 4.34Å; K270-P331 VanDerWaalsContact CG-O 3.31Å; K270-P331 WeakPolarHBondContact CG-O 3.48Å; P331-D333 VanDerWaalsContact C-N 3.26Å; P331-D333 PolarHBondContact O-N 3.46Å; P331-R334 PolarHBondContact O-N 3Å
332	S	97.6	Very high	98.4	Very high	98 Å²	98	49.7 Å²	49.7	69%	0.685	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-67	-25.8	178.8	53.1	0	0	0	0	113.8	N330 R334	N330-S332 PolarHBondContact O-N 2.96Å; S332-R334 VanDerWaalsContact C-N 3.28Å
333	D	98.6	Very high	98.4	Very high	87 Å²	87	49.7 Å²	49.7	47%	0.465	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-87	-5.9	-175.8	-57.6	-14.8	0	0	0	111.3	Q328 N330 P331	Q328-D333 HydrophobicContact CB-CB 3.95Å; Q328-D333 HydrophobicContact CG-CB 4.23Å; N330-D333 HydrophobicContact CB-CB 4.4Å; N330-D333 WeakPolarHBondContact CB-OD2 3.34Å; N330-D333 PolarHBondContact ND2-OD2 3.16Å; N330-D333 PolarHBondContact O-N 3.17Å; N330-D333 VanDerWaalsContact O-N 3.13Å; P331-D333 VanDerWaalsContact C-N 3.26Å; P331-D333 PolarHBondContact O-N 3.46Å
334	R	98.8	Very high	98.4	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.015	29%	0.286	C	S	.	.	S	Bend	trans	-81.8	145.3	175.8	-56.2	172.7	-165.9	153.5	8.8	109.8	E260 K270 V273 C326 Q328 W329 P331 S332	E260-R334 IonicContact OE1-CZ 3.88Å; E260-R334 IonicContact OE1-NH1 3.85Å; E260-R334 PolarHBondContact OE1-NH1 3.35Å; E260-R334 IonicContact OE1-NH2 2.6Å; E260-R334 IonicContact OE2-CZ 3.31Å; E260-R334 IonicContact OE2-NH1 2.7Å; E260-R334 PolarHBondContact OE2-NH1 2.66Å; E260-R334 IonicContact OE2-NH2 3.7Å; E260-R334 PolarHBondContact OE2-NH2 3.5Å; K270-R334 HydrophobicContact CD-CB 4.29Å; K270-R334 PolarHBondContact NZ-O 3.5Å; K270-R334 WeakPolarHBondContact O-CD 3.5Å; K270-R334 PolarHBondContact O-NH1 3.23Å; V273-R334 HydrophobicContact CG1-CB 3.95Å; C326-R334 VanDerWaalsContact O-CD 3.32Å; C326-R334 WeakPolarHBondContact O-CD 3.36Å; Q328-R334 HydrophobicContact CB-CG 3.94Å; Q328-R334 PolarHBondContact O-NE 2.84Å; Q328-R334 PolarHBondContact O-NH2 2.89Å; W329-R334 PolarHBondContact O-NH2 3.43Å; P331-R334 PolarHBondContact O-N 3Å; S332-R334 VanDerWaalsContact C-N 3.28Å
335	P	98.8	Very high	98.4	Very high	22 Å²	22	50 Å²	50	14%	0.143	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-63.4	160.2	174.6	28.3	-34.4	0	0	0	111.8	K270 V273 A325 E339 I340	K270-P335 PolarHBondContact NZ-O 3Å; V273-P335 HydrophobicContact CG1-CG 4.4Å; V273-P335 WeakPolarHBondContact CG2-O 3.28Å; A325-P335 HydrophobicContact CB-CG 4.23Å; A325-P335 WeakPolarHBondContact O-CD 3.32Å; P335-E339 HydrophobicContact CB-CB 4.12Å; P335-I340 HydrophobicContact CB-CG1 4.01Å; P335-I340 HydrophobicContact CG-CD1 4.03Å; P335-I340 HydrophobicContact CG-CG1 3.76Å
336	S	98.6	Very high	98.3	Very high	23 Å²	23	51.2 Å²	51.2	16%	0.161	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-79.3	161.9	165.7	59.6	0	0	0	0	110.5	E206 A338 E339 I340	E206-S336 WeakPolarHBondContact OE1-CB 3.34Å; S336-A338 PolarHBondContact O-N 3.39Å; S336-E339 WeakPolarHBondContact CB-OE2 3.34Å; S336-E339 PolarHBondContact N-OE2 2.63Å; S336-E339 PolarHBondContact O-N 2.87Å; S336-E339 VanDerWaalsContact O-N 3.1Å; S336-E339 VanDerWaalsContact OG-CD 3.25Å; S336-E339 VanDerWaalsContact OG-CG 3.24Å; S336-E339 WeakPolarHBondContact OG-CG 3.29Å; S336-E339 PolarHBondContact OG-N 3.38Å; S336-E339 PolarHBondContact OG-OE2 2.64Å; S336-I340 VanDerWaalsContact O-CG1 3.28Å; S336-I340 WeakPolarHBondContact O-CG1 3.45Å; S336-I340 PolarHBondContact O-N 3.28Å; S336-I340 VanDerWaalsContact O-N 3.11Å
337	F	98.6	Very high	98.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.9	175.4	-80.1	-69.4	0	0	0	113.2	M202 E203 E206 L215 I269 D272 V273 F276 I340	M202-F337 HydrophobicContact CB-CB 4.33Å; M202-F337 HydrophobicContact CB-CD1 3.34Å; M202-F337 HydrophobicContact CB-CD2 3.73Å; M202-F337 HydrophobicContact CB-CE1 3.33Å; M202-F337 HydrophobicContact CB-CE2 3.72Å; M202-F337 HydrophobicContact CB-CG 3.53Å; M202-F337 HydrophobicContact CB-CZ 3.52Å; M202-F337 HydrophobicContact CE-CE2 3.81Å; M202-F337 HydrophobicContact CE-CZ 3.85Å; M202-F337 HydrophobicContact CG-CD1 4.24Å; M202-F337 HydrophobicContact CG-CE1 3.75Å; M202-F337 HydrophobicContact CG-CE2 4.36Å; M202-F337 HydrophobicContact CG-CZ 3.81Å; E203-F337 HydrophobicContact CB-CB 4.05Å; E206-F337 HydrophobicContact CB-CD2 4.47Å; E206-F337 PolarHBondContact OE1-N 3.3Å; E206-F337 PolarHBondContact OE2-N 3.44Å; L215-F337 HydrophobicContact CD2-CZ 4.41Å; I269-F337 HydrophobicContact CD1-CD2 3.82Å; I269-F337 HydrophobicContact CD1-CE2 3.76Å; I269-F337 HydrophobicContact CG1-CD2 3.87Å; I269-F337 HydrophobicContact CG1-CE2 4.03Å; D272-F337 HydrophobicContact CB-CE2 3.95Å; D272-F337 HydrophobicContact CB-CZ 4.16Å; V273-F337 HydrophobicContact CB-CZ 4.49Å; V273-F337 HydrophobicContact CG2-CD2 3.87Å; V273-F337 HydrophobicContact CG2-CE1 4.39Å; V273-F337 HydrophobicContact CG2-CE2 3.61Å; V273-F337 HydrophobicContact CG2-CG 4.36Å; V273-F337 HydrophobicContact CG2-CZ 3.91Å; F276-F337 HydrophobicContact CB-CE1 3.7Å; F276-F337 HydrophobicContact CB-CZ 3.97Å; F276-F337 HydrophobicContact CD1-CE1 4.22Å; F276-F337 HydrophobicContact CD2-CE1 4.14Å; F276-F337 AromaticContact CG-CE1 3.76Å; F276-F337 HydrophobicContact CG-CE1 3.76Å; F337-I340 HydrophobicContact CD1-CD1 3.9Å; F337-I340 HydrophobicContact CE1-CD1 4.23Å; F337-I340 VanDerWaalsContact O-OXT 3.13Å
338	A	97.4	Very high	98.3	Very high	57 Å²	57	58.9 Å²	58.9	47%	0.471	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-26.7	170.4	0	0	0	0	0	113.6	E203 E206 S336	E203-A338 HydrophobicContact CG-CB 4.05Å; E206-A338 PolarHBondContact OE2-N 2.8Å; S336-A338 PolarHBondContact O-N 3.39Å
339	E	97.8	Very high	98.2	Very high	141 Å²	141	57.3 Å²	57.3	66%	0.659	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-28	175.8	-71.6	163.7	137.9	0	0	112.9	P335 S336	P335-E339 HydrophobicContact CB-CB 4.12Å; S336-E339 WeakPolarHBondContact CB-OE2 3.34Å; S336-E339 PolarHBondContact N-OE2 2.63Å; S336-E339 PolarHBondContact O-N 2.87Å; S336-E339 VanDerWaalsContact O-N 3.1Å; S336-E339 VanDerWaalsContact OG-CD 3.25Å; S336-E339 VanDerWaalsContact OG-CG 3.24Å; S336-E339 WeakPolarHBondContact OG-CG 3.29Å; S336-E339 PolarHBondContact OG-N 3.38Å; S336-E339 PolarHBondContact OG-OE2 2.64Å
340	I	97.1	Very high	98.2	Very high	49 Å²	49	54.7 Å²	54.7	25%	0.251	32%	0.322	S	S	.	.			trans	-73.1	0	174.9	-67.9	168.4	0	0	0	110.4	V273 F276 L322 P335 S336 F337	V273-I340 HydrophobicContact CG1-CD1 3.92Å; V273-I340 HydrophobicContact CG2-CD1 4.22Å; F276-I340 HydrophobicContact CD1-CD1 4.22Å; F276-I340 HydrophobicContact CD1-CG2 4Å; F276-I340 HydrophobicContact CE1-CG2 3.33Å; F276-I340 HydrophobicContact CZ-CG2 3.97Å; L322-I340 HydrophobicContact CD1-CG1 4.18Å; L322-I340 HydrophobicContact CD2-CG2 4.38Å; P335-I340 HydrophobicContact CB-CG1 4.01Å; P335-I340 HydrophobicContact CG-CD1 4.03Å; P335-I340 HydrophobicContact CG-CG1 3.76Å; S336-I340 VanDerWaalsContact O-CG1 3.28Å; S336-I340 WeakPolarHBondContact O-CG1 3.45Å; S336-I340 PolarHBondContact O-N 3.28Å; S336-I340 VanDerWaalsContact O-N 3.11Å; F337-I340 HydrophobicContact CD1-CD1 3.9Å; F337-I340 HydrophobicContact CE1-CD1 4.23Å; F337-I340 VanDerWaalsContact O-OXT 3.13Å

Retrieved 340 of 340 residues in 329.5 ms (Link to these results)

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