A0A077Z5Y1_TRITR Loading...

G2:M phase specific E3 ubiquitin protein ligase

AlphaFold DB , UniProt , Accession A0A077Z5Y1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 607 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.8	Very low	44.7	Very low	249 Å²	249	152.4 Å²	152.4	100%	1.227	87%	0.871	S	S	*	*				0	110.2	0	-68.1	-177.3	179.5	0	0	107.2
2	A	41.7	Very low	44.2	Very low	102 Å²	102	152.8 Å²	152.8	84%	0.843	87%	0.869	S	S	*	*	P	Polyproline II helix	trans	-81.6	138.5	-163.2	0	0	0	0	0	112.6
3	T	44.4	Very low	43.9	Very low	131 Å²	131	148.6 Å²	148.6	80%	0.804	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-69.3	137.1	171.9	46.6	0	0	0	0	111.3	S5	T3-S5 PolarHBondContact O-N 3.37Å
4	P	43.3	Very low	43.6	Very low	125 Å²	125	143.1 Å²	143.1	81%	0.812	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-78.9	120.5	172.7	30.6	-28.8	0	0	0	110.1
5	S	42.7	Very low	44.1	Very low	120 Å²	120	140.7 Å²	140.7	84%	0.839	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-67.3	125.8	174.8	-163.2	0	0	0	0	110.6	T3	T3-S5 PolarHBondContact O-N 3.37Å
6	K	54.9	Low	45.1	Very low	205 Å²	205	137 Å²	137	89%	0.891	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-82.8	119.9	176	-112.5	179.5	179.7	-179	0	110
7	V	53.4	Low	46.3	Very low	126 Å²	126	139.6 Å²	139.6	76%	0.764	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-54.9	137.6	173.2	179.7	0	0	0	0	111.3	Q9	V7-Q9 PolarHBondContact O-N 2.77Å
8	P	38.6	Very low	48.6	Very low	119 Å²	119	137.6 Å²	137.6	77%	0.773	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-73.4	121	176.7	28.9	-31.2	0	0	0	110.6	K10	P8-K10 PolarHBondContact O-N 3.26Å
9	Q	44.3	Very low	50.9	Low	194 Å²	194	132.6 Å²	132.6	91%	0.907	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-70.2	123.1	171.5	-73.6	179.4	-18.4	0	0	109.8	V7	V7-Q9 PolarHBondContact O-N 2.77Å
10	K	41.5	Very low	53.1	Low	203 Å²	203	126 Å²	126	88%	0.883	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-55.7	134.4	171.4	-82.2	177.2	172.6	178.1	0	110.3	P8 N12	P8-K10 PolarHBondContact O-N 3.26Å; K10-N12 PolarHBondContact O-N 3.41Å
11	A	39	Very low	55	Low	102 Å²	102	120.9 Å²	120.9	84%	0.843	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-57.3	118.7	172.9	0	0	0	0	0	110.2	A13	A11-A13 PolarHBondContact O-N 3.38Å
12	N	39.4	Very low	57.3	Low	158 Å²	158	109.1 Å²	109.1	85%	0.845	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-64.6	121.8	171.2	-145.2	2.3	0	0	0	107.7	K10 G14	K10-N12 PolarHBondContact O-N 3.41Å; N12-G14 PolarHBondContact O-N 2.94Å
13	A	40	Very low	59.8	Low	98 Å²	98	104.8 Å²	104.8	81%	0.81	62%	0.615	S	S	*	*			trans	-56.9	112.5	178.6	0	0	0	0	0	109.1	A11	A11-A13 PolarHBondContact O-N 3.38Å
14	G	39.9	Very low	62	Low	72 Å²	72	103.3 Å²	103.3	74%	0.742	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-67.6	137.2	-168.2	0	0	0	0	0	112.8	N12	N12-G14 PolarHBondContact O-N 2.94Å
15	S	51.4	Low	64.2	Low	106 Å²	106	101.7 Å²	101.7	74%	0.741	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-53	144.7	168.5	50	0	0	0	0	110.9	K17	S15-K17 PolarHBondContact O-N 2.98Å
16	P	59.7	Low	66.1	Low	82 Å²	82	101.1 Å²	101.1	53%	0.532	57%	0.566	S	S	.	*	P	Polyproline II helix	trans	-58.2	125.6	-180	22.5	-31.8	0	0	0	109.9	Q18	P16-Q18 PolarHBondContact O-N 3.5Å
17	K	65.5	Low	67.1	Low	182 Å²	182	94.2 Å²	94.2	79%	0.791	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-60.1	126.2	178.4	-72	-173.5	178.3	-176.8	0	109.5	S15 V19	S15-K17 PolarHBondContact O-N 2.98Å; K17-V19 HydrophobicContact CB-CG1 4.28Å; K17-V19 HydrophobicContact CB-CG2 4.46Å; K17-V19 PolarHBondContact O-N 2.86Å
18	Q	86.7	Confident	67.9	Low	103 Å²	103	92 Å²	92	48%	0.481	53%	0.534	S	S	.	.			trans	-76.8	68.8	-179.9	-56.1	-175.9	-20	0	0	110.4	P16 L36 Y45	P16-Q18 PolarHBondContact O-N 3.5Å; Q18-L36 WeakPolarHBondContact O-CD2 3.18Å; Q18-Y45 HydrophobicContact CB-CD1 4.09Å; Q18-Y45 HydrophobicContact CB-CE1 3.87Å; Q18-Y45 HydrophobicContact CB-CE2 4.36Å; Q18-Y45 HydrophobicContact CB-CG 4.41Å; Q18-Y45 HydrophobicContact CG-CD1 4.49Å; Q18-Y45 HydrophobicContact CG-CE1 3.77Å; Q18-Y45 HydrophobicContact CG-CE2 4.14Å; Q18-Y45 PolarHBondContact NE2-OH 3.16Å
19	V	92.5	Very high	69.6	Low	42 Å²	42	88.8 Å²	88.8	26%	0.255	51%	0.514	S	S	.	.			trans	-115.3	144.7	-178.7	-66.8	0	0	0	0	110.6	K17 V21 D26	K17-V19 HydrophobicContact CB-CG1 4.28Å; K17-V19 HydrophobicContact CB-CG2 4.46Å; K17-V19 PolarHBondContact O-N 2.86Å; V19-V21 PolarHBondContact O-N 3.24Å; V19-D26 HydrophobicContact CG1-CB 3.9Å
20	C	94.8	Very high	70.9	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	49%	0.486	C	S	.	.			trans	-59.6	132	176	169.3	0	0	0	0	111.5	F22 C23 K24 E25 L36 Y45 H47	C20-F22 PolarHBondContact O-N 3.44Å; C20-F22 PolarHBondContact SG-N 2.92Å; C20-F22 VanDerWaalsContact SG-N 3.43Å; C20-C23 VanDerWaalsContact CB-SG 3.5Å; C20-K24 WeakPolarHBondContact O-CA 3.19Å; C20-K24 PolarHBondContact O-N 3.22Å; C20-E25 PolarHBondContact N-O 3.11Å; C20-L36 HydrophobicContact CB-CD1 3.96Å; C20-Y45 CarbonylContact C-O 3.55Å; C20-Y45 WeakPolarHBondContact CA-O 3.27Å; C20-H47 VanDerWaalsContact CB-CE1 3.49Å; C20-H47 WeakPolarHBondContact CB-CE1 3.35Å; C20-H47 WeakPolarHBondContact CB-ND1 3.46Å
21	V	94.4	Very high	72.4	Confident	20 Å²	20	76.7 Å²	76.7	12%	0.121	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-30.2	-178	68.4	0	0	0	0	113.7	V19 K24 Y45 I46 I75 A79 R94	V19-V21 PolarHBondContact O-N 3.24Å; V21-K24 WeakPolarHBondContact O-CE 3.22Å; V21-K24 PolarHBondContact O-NZ 3.04Å; V21-Y45 PolarHBondContact N-O 3.39Å; V21-I46 HydrophobicContact CG1-CB 4.21Å; V21-I46 HydrophobicContact CG1-CD1 4.11Å; V21-I46 HydrophobicContact CG1-CG1 4.28Å; V21-I75 HydrophobicContact CG1-CG2 3.58Å; V21-A79 HydrophobicContact CG2-CB 3.79Å; V21-R94 VanDerWaalsContact O-CD 3.31Å; V21-R94 WeakPolarHBondContact O-CD 3.18Å; V21-R94 PolarHBondContact O-NH1 2.94Å
22	F	95	Very high	74.6	Confident	1 Å²	1	72.8 Å²	72.8	0%	0.004	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-60.5	179.5	-64.7	-29.2	0	0	0	113	C20 I46 C50 S54 L57 I75 L78 A79 R94 T96	C20-F22 PolarHBondContact O-N 3.44Å; C20-F22 PolarHBondContact SG-N 2.92Å; C20-F22 VanDerWaalsContact SG-N 3.43Å; F22-I46 HydrophobicContact CD2-CD1 3.66Å; F22-I46 HydrophobicContact CD2-CG1 4.33Å; F22-I46 HydrophobicContact CE2-CD1 3.36Å; F22-I46 HydrophobicContact CE2-CG1 4.46Å; F22-I46 HydrophobicContact CZ-CD1 4Å; F22-C50 HydrophobicContact CB-CB 4.5Å; F22-C50 HydrophobicContact CD2-CB 4.07Å; F22-S54 WeakPolarHBondContact CD2-OG 3.49Å; F22-S54 WeakPolarHBondContact CE2-OG 3.41Å; F22-L57 HydrophobicContact CE2-CD1 4.17Å; F22-L57 HydrophobicContact CZ-CD1 4.25Å; F22-I75 HydrophobicContact CE1-CG2 4.29Å; F22-I75 HydrophobicContact CZ-CG2 3.95Å; F22-L78 HydrophobicContact CE1-CB 4.35Å; F22-L78 HydrophobicContact CE1-CD2 4.44Å; F22-L78 HydrophobicContact CE1-CG 4.4Å; F22-L78 HydrophobicContact CZ-CB 4.3Å; F22-L78 HydrophobicContact CZ-CD2 3.86Å; F22-L78 HydrophobicContact CZ-CG 4.27Å; F22-A79 HydrophobicContact CD1-CB 3.79Å; F22-A79 HydrophobicContact CE1-CB 3.62Å; F22-R94 VanDerWaalsContact O-CB 3.24Å; F22-R94 WeakPolarHBondContact O-CB 3.22Å; F22-T96 HydrophobicContact CD1-CG2 3.79Å; F22-T96 HydrophobicContact CD2-CG2 4.35Å; F22-T96 HydrophobicContact CE1-CG2 3.87Å; F22-T96 HydrophobicContact CE2-CG2 4.41Å; F22-T96 HydrophobicContact CG-CG2 4.07Å; F22-T96 HydrophobicContact CZ-CG2 4.21Å
23	C	93.7	Very high	76.8	Confident	11 Å²	11	65.9 Å²	65.9	7%	0.074	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-15.5	-173.6	72.9	0	0	0	0	114.1	C20 E25 H47 H107	C20-C23 VanDerWaalsContact CB-SG 3.5Å; C23-E25 PolarHBondContact O-N 2.64Å; C23-H47 VanDerWaalsContact SG-CE1 3.59Å; C23-H47 PolarHBondContact SG-ND1 3.39Å; C23-H107 HydrophobicContact CB-CB 4.29Å
24	K	92.1	Very high	79.1	Confident	100 Å²	100	61.2 Å²	61.2	44%	0.435	36%	0.356	S	S	.	.			trans	63.5	15.6	-177.1	-54.7	-57.1	-171.2	-165.5	0	115.3	C20 V21	C20-K24 WeakPolarHBondContact O-CA 3.19Å; C20-K24 PolarHBondContact O-N 3.22Å; V21-K24 WeakPolarHBondContact O-CE 3.22Å; V21-K24 PolarHBondContact O-NZ 3.04Å
25	E	88.8	Confident	81.4	Confident	91 Å²	91	60.9 Å²	60.9	43%	0.425	34%	0.337	S	S	.	.			trans	-92.7	145.2	171.9	-55.6	-63.1	155.7	0	0	110.1	C20 C23	C20-E25 PolarHBondContact N-O 3.11Å; C23-E25 PolarHBondContact O-N 2.64Å
26	D	81.8	Confident	83.3	Confident	108 Å²	108	57.5 Å²	57.5	58%	0.578	31%	0.311	S	S	*	.			trans	-89.8	-18	174.1	52.4	6.6	0	0	0	112.8	V19 S28	V19-D26 HydrophobicContact CG1-CB 3.9Å; D26-S28 PolarHBondContact O-N 2.89Å
27	S	75.9	Confident	84.8	Confident	61 Å²	61	57.6 Å²	57.6	43%	0.427	30%	0.3	S	S	.	.			trans	-60.5	109.4	-174.6	66.5	0	0	0	0	111.7	H47	S27-H47 PolarHBondContact O-NE2 3.46Å
28	S	71.4	Confident	86	Confident	78 Å²	78	54.7 Å²	54.7	55%	0.545	28%	0.284	S	S	.	.			trans	-94.3	108.5	168.3	60.4	0	0	0	0	109.1	D26	D26-S28 PolarHBondContact O-N 2.89Å
29	S	73.8	Confident	86	Confident	52 Å²	52	50.4 Å²	50.4	36%	0.364	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-139.5	134.1	165.3	53.6	0	0	0	0	108.5	E31 G32 S33 G34	S29-E31 PolarHBondContact O-N 2.9Å; S29-G32 WeakPolarHBondContact O-CA 3.35Å; S29-G32 PolarHBondContact O-N 2.97Å; S29-G32 VanDerWaalsContact OG-CA 3.27Å; S29-G32 WeakPolarHBondContact OG-CA 3.31Å; S29-G32 PolarHBondContact OG-N 3.46Å; S29-S33 PolarHBondContact O-N 3.48Å; S29-G34 CarbonylContact O-C 3.58Å; S29-G34 PolarHBondContact O-N 2.9Å; S29-G34 VanDerWaalsContact O-N 3.12Å
30	E	70.9	Confident	85.7	Confident	65 Å²	65	51.2 Å²	51.2	30%	0.304	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-36.6	173	-65.8	-171.1	-165.8	0	0	110.9	G32 L35 L184 R216	E30-G32 VanDerWaalsContact C-N 3.3Å; E30-G32 PolarHBondContact O-N 3.35Å; E30-L35 HydrophobicContact CG-CD2 3.54Å; E30-L35 HydrophobicContact CG-CG 3.95Å; E30-L184 HydrophobicContact CB-CD1 4.44Å; E30-L184 HydrophobicContact CB-CD2 4.03Å; E30-R216 IonicContact OE2-CZ 3.5Å; E30-R216 IonicContact OE2-NE 3.48Å; E30-R216 PolarHBondContact OE2-NE 3.22Å; E30-R216 IonicContact OE2-NH2 2.71Å; E30-R216 PolarHBondContact OE2-NH2 3.09Å
31	E	74.1	Confident	85.2	Confident	79 Å²	79	58.1 Å²	58.1	37%	0.369	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-29.7	172.3	-170.7	178	-179.8	0	0	111.8	S29 R112 L184	S29-E31 PolarHBondContact O-N 2.9Å; E31-R112 VanDerWaalsContact CG-NH2 3.31Å; E31-R112 PolarHBondContact O-NH1 3.26Å; E31-R112 PolarHBondContact O-NH2 3.34Å; E31-R112 IonicContact OE1-NH2 3.86Å; E31-L184 HydrophobicContact CB-CD1 3.7Å; E31-L184 HydrophobicContact CG-CD1 4.21Å
32	G	83.8	Confident	84.9	Confident	20 Å²	20	60.8 Å²	60.8	21%	0.206	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-110.1	-178.4	0	0	0	0	0	112.2	S29 E30 G34 F108 R112	S29-G32 WeakPolarHBondContact O-CA 3.35Å; S29-G32 PolarHBondContact O-N 2.97Å; S29-G32 VanDerWaalsContact OG-CA 3.27Å; S29-G32 WeakPolarHBondContact OG-CA 3.31Å; S29-G32 PolarHBondContact OG-N 3.46Å; E30-G32 VanDerWaalsContact C-N 3.3Å; E30-G32 PolarHBondContact O-N 3.35Å; G32-G34 VanDerWaalsContact C-N 3.32Å; G32-F108 WeakPolarHBondContact O-CE1 3.43Å; G32-R112 PolarHBondContact O-NH1 3.25Å
33	S	86.8	Confident	84.5	Confident	12 Å²	12	65.4 Å²	65.4	8%	0.084	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	9.9	-178.7	-56.6	0	0	0	0	113.1	S29 H47 F49	S29-S33 PolarHBondContact O-N 3.48Å; S33-H47 WeakPolarHBondContact O-CB 3.36Å; S33-F49 WeakPolarHBondContact O-CB 3.4Å; S33-F49 VanDerWaalsContact O-CD2 3.31Å; S33-F49 WeakPolarHBondContact O-CD2 3.36Å; S33-F49 WeakPolarHBondContact O-CG 3.12Å; S33-F49 PolarHBondContact O-N 2.99Å
34	G	88.7	Confident	84.3	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	89.6	-178.8	-171.8	0	0	0	0	0	111.9	S29 G32 F49	S29-G34 CarbonylContact O-C 3.58Å; S29-G34 PolarHBondContact O-N 2.9Å; S29-G34 VanDerWaalsContact O-N 3.12Å; G32-G34 VanDerWaalsContact C-N 3.32Å; G34-F49 VanDerWaalsContact N-CD2 3.29Å
35	L	88	Confident	84.4	Confident	65 Å²	65	61.5 Å²	61.5	34%	0.34	33%	0.33	S	S	.	.			trans	-65.4	146.6	178	-62.2	173.1	0	0	0	110.7	E30 R37 H47 E48	E30-L35 HydrophobicContact CG-CD2 3.54Å; E30-L35 HydrophobicContact CG-CG 3.95Å; L35-R37 PolarHBondContact O-N 3.22Å; L35-H47 WeakPolarHBondContact O-CA 3.27Å; L35-E48 HydrophobicContact CB-CG 4.26Å; L35-E48 PolarHBondContact N-OE2 3.38Å; L35-E48 PolarHBondContact O-N 3.16Å
36	L	91	Very high	84.6	Confident	36 Å²	36	57.2 Å²	57.2	19%	0.188	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	101.8	172.5	-172.1	71.3	0	0	0	108.4	Q18 C20 Y45	Q18-L36 WeakPolarHBondContact O-CD2 3.18Å; C20-L36 HydrophobicContact CB-CD1 3.96Å; L36-Y45 HydrophobicContact CD2-CD1 4.01Å; L36-Y45 HydrophobicContact CD2-CG 4.45Å; L36-Y45 HydrophobicContact CG-CD1 4.24Å
37	R	90.5	Very high	85.2	Confident	83 Å²	83	52 Å²	52	31%	0.313	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	147.8	177.7	-60	-61.5	-171.1	123.5	-2.1	110.2	L35 Y45 I46 E48 L67 M68	L35-R37 PolarHBondContact O-N 3.22Å; R37-Y45 CarbonylContact O-C 3.6Å; R37-Y45 VanDerWaalsContact O-CA 3.28Å; R37-Y45 WeakPolarHBondContact O-CA 2.99Å; R37-I46 PolarHBondContact N-O 2.87Å; R37-I46 PolarHBondContact O-N 3.17Å; R37-E48 HydrophobicContact CG-CG 3.8Å; R37-E48 IonicContact CZ-OE1 3.1Å; R37-E48 IonicContact NE-OE1 2.74Å; R37-E48 PolarHBondContact NE-OE1 3.05Å; R37-E48 IonicContact NH2-OE1 2.65Å; R37-E48 PolarHBondContact NH2-OE1 2.72Å; R37-L67 HydrophobicContact CB-CD2 3.75Å; R37-M68 PolarHBondContact NH2-SD 3.03Å; R37-M68 VanDerWaalsContact NH2-SD 3.41Å
38	R	90.3	Very high	86	Confident	122 Å²	122	49.6 Å²	49.6	46%	0.46	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.1	176.3	-176.4	-167.5	-66.8	-156.1	2.6	109.3	L44 Y45	R38-L44 WeakPolarHBondContact CA-O 3.38Å; R38-Y45 HydrophobicContact CB-CD1 4.16Å; R38-Y45 HydrophobicContact CB-CE1 4.08Å; R38-Y45 HydrophobicContact CG-CD1 4.33Å; R38-Y45 HydrophobicContact CG-CE1 3.94Å; R38-Y45 VanDerWaalsContact NE-CE1 3.32Å; R38-Y45 PolarHBondContact NE-OH 3.2Å; R38-Y45 VanDerWaalsContact NE-OH 3.09Å; R38-Y45 PolarHBondContact NH2-OH 2.86Å
39	D	88.7	Confident	87	Confident	12 Å²	12	45.9 Å²	45.9	6%	0.064	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.1	157.2	159	-3.9	0	0	0	107.1	D41 L42 Q43 L44 L67	D39-D41 VanDerWaalsContact C-N 3.34Å; D39-D41 PolarHBondContact OD1-N 3.21Å; D39-L42 PolarHBondContact OD1-N 3.12Å; D39-L42 VanDerWaalsContact OD1-N 3.07Å; D39-Q43 VanDerWaalsContact O-CA 3.32Å; D39-Q43 WeakPolarHBondContact O-CA 3.37Å; D39-Q43 PolarHBondContact O-N 3.42Å; D39-L44 HydrophobicContact CB-CD1 4.15Å; D39-L44 HydrophobicContact CB-CD2 4.16Å; D39-L44 HydrophobicContact CB-CG 3.83Å; D39-L44 PolarHBondContact N-O 3.14Å; D39-L44 PolarHBondContact O-N 2.76Å; D39-L67 HydrophobicContact CB-CD1 3.67Å; D39-L67 HydrophobicContact CB-CD2 3.93Å; D39-L67 HydrophobicContact CB-CG 3.75Å
40	A	85.4	Confident	88.1	Confident	59 Å²	59	43.6 Å²	43.6	49%	0.488	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-31.5	-171.8	0	0	0	0	0	111.9	Q43	A40-Q43 PolarHBondContact O-NE2 3.27Å
41	D	84.9	Confident	89.1	Confident	145 Å²	145	40.5 Å²	40.5	78%	0.775	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-41.1	-176.5	-60.1	-23.9	0	0	0	110.4	D39	D39-D41 VanDerWaalsContact C-N 3.34Å; D39-D41 PolarHBondContact OD1-N 3.21Å
42	L	86.6	Confident	90	Very high	77 Å²	77	37.5 Å²	37.5	40%	0.403	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-1.8	178.8	-64.4	178.8	0	0	0	113.8	D39 L44 G72 K73	D39-L42 PolarHBondContact OD1-N 3.12Å; D39-L42 VanDerWaalsContact OD1-N 3.07Å; L42-L44 HydrophobicContact CB-CB 4.47Å; L42-L44 HydrophobicContact CB-CD2 3.67Å; L42-L44 HydrophobicContact CB-CG 4.23Å; L42-L44 HydrophobicContact CD1-CD2 3.74Å; L42-L44 HydrophobicContact CG-CD2 4.36Å; L42-L44 PolarHBondContact O-N 3.2Å; L42-L44 VanDerWaalsContact O-N 3.13Å; L42-G72 VanDerWaalsContact CD1-C 3.43Å; L42-K73 HydrophobicContact CD1-CG 4.05Å
43	Q	87.2	Confident	90.5	Very high	97 Å²	97	36.7 Å²	36.7	45%	0.453	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	37	-174.6	-66.6	-68.5	-49.6	0	0	112.9	D39 A40	D39-Q43 VanDerWaalsContact O-CA 3.32Å; D39-Q43 WeakPolarHBondContact O-CA 3.37Å; D39-Q43 PolarHBondContact O-N 3.42Å; A40-Q43 PolarHBondContact O-NE2 3.27Å
44	L	90.4	Very high	90.9	Very high	13 Å²	13	36.1 Å²	36.1	7%	0.068	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	151	-179	75.3	85.6	0	0	0	110.7	R38 D39 L42 I46 L67 V76	R38-L44 WeakPolarHBondContact CA-O 3.38Å; D39-L44 HydrophobicContact CB-CD1 4.15Å; D39-L44 HydrophobicContact CB-CD2 4.16Å; D39-L44 HydrophobicContact CB-CG 3.83Å; D39-L44 PolarHBondContact N-O 3.14Å; D39-L44 PolarHBondContact O-N 2.76Å; L42-L44 HydrophobicContact CB-CB 4.47Å; L42-L44 HydrophobicContact CB-CD2 3.67Å; L42-L44 HydrophobicContact CB-CG 4.23Å; L42-L44 HydrophobicContact CD1-CD2 3.74Å; L42-L44 HydrophobicContact CG-CD2 4.36Å; L42-L44 PolarHBondContact O-N 3.2Å; L42-L44 VanDerWaalsContact O-N 3.13Å; L44-I46 HydrophobicContact CD1-CB 4.48Å; L44-I46 HydrophobicContact CD1-CG2 4.13Å; L44-L67 HydrophobicContact CD1-CD1 3.81Å; L44-L67 HydrophobicContact CD1-CD2 4.38Å; L44-V76 HydrophobicContact CD2-CG2 4.15Å
45	Y	92.9	Very high	90.8	Very high	17 Å²	17	39.4 Å²	39.4	7%	0.067	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	138.5	176	-60.2	-102.1	0	0	0	109.5	Q18 C20 V21 L36 R37 R38	Q18-Y45 HydrophobicContact CB-CD1 4.09Å; Q18-Y45 HydrophobicContact CB-CE1 3.87Å; Q18-Y45 HydrophobicContact CB-CE2 4.36Å; Q18-Y45 HydrophobicContact CB-CG 4.41Å; Q18-Y45 HydrophobicContact CG-CD1 4.49Å; Q18-Y45 HydrophobicContact CG-CE1 3.77Å; Q18-Y45 HydrophobicContact CG-CE2 4.14Å; Q18-Y45 PolarHBondContact NE2-OH 3.16Å; C20-Y45 CarbonylContact C-O 3.55Å; C20-Y45 WeakPolarHBondContact CA-O 3.27Å; V21-Y45 PolarHBondContact N-O 3.39Å; L36-Y45 HydrophobicContact CD2-CD1 4.01Å; L36-Y45 HydrophobicContact CD2-CG 4.45Å; L36-Y45 HydrophobicContact CG-CD1 4.24Å; R37-Y45 CarbonylContact O-C 3.6Å; R37-Y45 VanDerWaalsContact O-CA 3.28Å; R37-Y45 WeakPolarHBondContact O-CA 2.99Å; R38-Y45 HydrophobicContact CB-CD1 4.16Å; R38-Y45 HydrophobicContact CB-CE1 4.08Å; R38-Y45 HydrophobicContact CG-CD1 4.33Å; R38-Y45 HydrophobicContact CG-CE1 3.94Å; R38-Y45 VanDerWaalsContact NE-CE1 3.32Å; R38-Y45 PolarHBondContact NE-OH 3.2Å; R38-Y45 VanDerWaalsContact NE-OH 3.09Å; R38-Y45 PolarHBondContact NH2-OH 2.86Å
46	I	93.4	Very high	90.6	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	138.2	179.8	-174.1	165	0	0	0	110.6	V21 F22 R37 L44 C50 M51 L67 I75	V21-I46 HydrophobicContact CG1-CB 4.21Å; V21-I46 HydrophobicContact CG1-CD1 4.11Å; V21-I46 HydrophobicContact CG1-CG1 4.28Å; F22-I46 HydrophobicContact CD2-CD1 3.66Å; F22-I46 HydrophobicContact CD2-CG1 4.33Å; F22-I46 HydrophobicContact CE2-CD1 3.36Å; F22-I46 HydrophobicContact CE2-CG1 4.46Å; F22-I46 HydrophobicContact CZ-CD1 4Å; R37-I46 PolarHBondContact N-O 2.87Å; R37-I46 PolarHBondContact O-N 3.17Å; L44-I46 HydrophobicContact CD1-CB 4.48Å; L44-I46 HydrophobicContact CD1-CG2 4.13Å; I46-C50 HydrophobicContact CG1-CB 4.44Å; I46-M51 HydrophobicContact CD1-CB 3.8Å; I46-M51 HydrophobicContact CD1-CG 4.22Å; I46-M51 HydrophobicContact CG1-CB 4.16Å; I46-M51 HydrophobicContact CG2-SD 4.36Å; I46-L67 HydrophobicContact CG2-CD1 4.47Å; I46-L67 HydrophobicContact CG2-CD2 3.93Å; I46-I75 HydrophobicContact CD1-CD1 4.09Å; I46-I75 HydrophobicContact CD1-CG1 4.17Å; I46-I75 HydrophobicContact CD1-CG2 3.63Å; I46-I75 HydrophobicContact CG2-CD1 4.38Å
47	H	94.5	Very high	90.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	139.7	172.3	-63.9	119.7	0	0	0	111	C20 C23 S27 S33 L35 F49 C50 M51	C20-H47 VanDerWaalsContact CB-CE1 3.49Å; C20-H47 WeakPolarHBondContact CB-CE1 3.35Å; C20-H47 WeakPolarHBondContact CB-ND1 3.46Å; C23-H47 VanDerWaalsContact SG-CE1 3.59Å; C23-H47 PolarHBondContact SG-ND1 3.39Å; S27-H47 PolarHBondContact O-NE2 3.46Å; S33-H47 WeakPolarHBondContact O-CB 3.36Å; L35-H47 WeakPolarHBondContact O-CA 3.27Å; H47-F49 VanDerWaalsContact C-N 3.35Å; H47-F49 PolarHBondContact O-N 3.33Å; H47-C50 HydrophobicContact CB-CB 3.93Å; H47-C50 WeakPolarHBondContact O-CA 3.29Å; H47-C50 WeakPolarHBondContact O-CB 3.34Å; H47-C50 PolarHBondContact O-N 3.32Å; H47-M51 PolarHBondContact O-N 2.96Å
48	E	92	Very high	90.1	Very high	9 Å²	9	39.5 Å²	39.5	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-49.6	-50.9	177.4	-71.2	169.3	158.2	0	0	112.6	L35 R37 C50 M51 Y52	L35-E48 HydrophobicContact CB-CG 4.26Å; L35-E48 PolarHBondContact N-OE2 3.38Å; L35-E48 PolarHBondContact O-N 3.16Å; R37-E48 HydrophobicContact CG-CG 3.8Å; R37-E48 IonicContact CZ-OE1 3.1Å; R37-E48 IonicContact NE-OE1 2.74Å; R37-E48 PolarHBondContact NE-OE1 3.05Å; R37-E48 IonicContact NH2-OE1 2.65Å; R37-E48 PolarHBondContact NH2-OE1 2.72Å; E48-C50 VanDerWaalsContact C-N 3.32Å; E48-C50 PolarHBondContact O-N 2.75Å; E48-M51 WeakPolarHBondContact O-CA 3.49Å; E48-M51 VanDerWaalsContact O-CB 3.31Å; E48-M51 WeakPolarHBondContact O-CB 3.34Å; E48-M51 PolarHBondContact O-N 2.97Å; E48-Y52 HydrophobicContact CB-CE2 3.95Å; E48-Y52 WeakPolarHBondContact O-CD2 3.31Å; E48-Y52 VanDerWaalsContact O-CG 3.31Å; E48-Y52 PolarHBondContact O-N 3.06Å
49	F	94.1	Very high	89.7	Confident	1 Å²	1	34.6 Å²	34.6	0%	0.004	19%	0.191	C	C	.	.	H	α-helix	trans	-77.1	-21.5	-178.5	-51.7	-35.1	0	0	0	112.9	S33 G34 H47 M51 Y52 F53 F108 F120 Y212	S33-F49 WeakPolarHBondContact O-CB 3.4Å; S33-F49 VanDerWaalsContact O-CD2 3.31Å; S33-F49 WeakPolarHBondContact O-CD2 3.36Å; S33-F49 WeakPolarHBondContact O-CG 3.12Å; S33-F49 PolarHBondContact O-N 2.99Å; G34-F49 VanDerWaalsContact N-CD2 3.29Å; H47-F49 VanDerWaalsContact C-N 3.35Å; H47-F49 PolarHBondContact O-N 3.33Å; F49-M51 VanDerWaalsContact C-N 3.27Å; F49-Y52 AromaticContact CD1-CD2 3.91Å; F49-Y52 HydrophobicContact CD1-CD2 3.91Å; F49-Y52 HydrophobicContact CD1-CE2 4.24Å; F49-Y52 HydrophobicContact CE1-CD2 4.44Å; F49-Y52 HydrophobicContact CE1-CE2 4.42Å; F49-F53 HydrophobicContact CB-CD2 4.06Å; F49-F53 HydrophobicContact CB-CE2 4.26Å; F49-F53 HydrophobicContact CD1-CE2 4.44Å; F49-F53 WeakPolarHBondContact O-CD2 3.45Å; F49-F53 PolarHBondContact O-N 3.1Å; F49-F108 HydrophobicContact CB-CD1 4.03Å; F49-F108 HydrophobicContact CB-CD2 3.45Å; F49-F108 VanDerWaalsContact CB-CD2 3.45Å; F49-F108 HydrophobicContact CB-CE1 4.01Å; F49-F108 HydrophobicContact CB-CE2 3.43Å; F49-F108 VanDerWaalsContact CB-CE2 3.43Å; F49-F108 HydrophobicContact CB-CG 3.76Å; F49-F108 HydrophobicContact CB-CZ 3.71Å; F49-F108 HydrophobicContact CD2-CD1 4.28Å; F49-F108 AromaticContact CD2-CE1 3.6Å; F49-F108 HydrophobicContact CD2-CE1 3.6Å; F49-F108 HydrophobicContact CD2-CE2 4.09Å; F49-F108 AromaticContact CD2-CZ 3.47Å; F49-F108 HydrophobicContact CD2-CZ 3.47Å; F49-F108 VanDerWaalsContact CD2-CZ 3.47Å; F49-F108 HydrophobicContact CE2-CZ 4.35Å; F49-F108 HydrophobicContact CG-CD2 4.43Å; F49-F108 HydrophobicContact CG-CE1 4.21Å; F49-F108 AromaticContact CG-CE2 3.95Å; F49-F108 HydrophobicContact CG-CE2 3.95Å; F49-F108 AromaticContact CG-CZ 3.82Å; F49-F108 HydrophobicContact CG-CZ 3.82Å; F49-F120 HydrophobicContact CD1-CD1 4.37Å; F49-F120 HydrophobicContact CD1-CE1 4.01Å; F49-F120 HydrophobicContact CD2-CE1 4.28Å; F49-F120 HydrophobicContact CE1-CD1 4.14Å; F49-F120 AromaticContact CE1-CE1 3.93Å; F49-F120 HydrophobicContact CE1-CE1 3.93Å; F49-F120 HydrophobicContact CE2-CE1 4.22Å; F49-F120 HydrophobicContact CG-CE1 4.21Å; F49-F120 HydrophobicContact CZ-CE1 4.06Å; F49-Y212 HydrophobicContact CE1-CD1 4.32Å; F49-Y212 HydrophobicContact CE1-CD2 4.1Å; F49-Y212 HydrophobicContact CE1-CE1 4.11Å; F49-Y212 AromaticContact CE1-CE2 3.87Å; F49-Y212 HydrophobicContact CE1-CE2 3.87Å; F49-Y212 HydrophobicContact CE1-CG 4.3Å; F49-Y212 AromaticContact CE1-CZ 3.86Å; F49-Y212 HydrophobicContact CE2-CD1 4.41Å; F49-Y212 AromaticContact CZ-CD1 3.55Å; F49-Y212 HydrophobicContact CZ-CD1 3.55Å; F49-Y212 HydrophobicContact CZ-CD2 4.09Å; F49-Y212 AromaticContact CZ-CE1 3.53Å; F49-Y212 HydrophobicContact CZ-CE1 3.53Å; F49-Y212 HydrophobicContact CZ-CE2 4.07Å; F49-Y212 AromaticContact CZ-CG 3.82Å; F49-Y212 HydrophobicContact CZ-CG 3.82Å; F49-Y212 AromaticContact CZ-CZ 3.78Å
50	C	95	Very high	89.1	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.02	20%	0.204	C	C	.	.	H	α-helix	trans	-66	-36.4	166.1	-72.9	0	0	0	0	110.6	F22 I46 H47 E48 S54	F22-C50 HydrophobicContact CB-CB 4.5Å; F22-C50 HydrophobicContact CD2-CB 4.07Å; I46-C50 HydrophobicContact CG1-CB 4.44Å; H47-C50 HydrophobicContact CB-CB 3.93Å; H47-C50 WeakPolarHBondContact O-CA 3.29Å; H47-C50 WeakPolarHBondContact O-CB 3.34Å; H47-C50 PolarHBondContact O-N 3.32Å; E48-C50 VanDerWaalsContact C-N 3.32Å; E48-C50 PolarHBondContact O-N 2.75Å; C50-S54 WeakPolarHBondContact O-CB 3.19Å; C50-S54 PolarHBondContact O-OG 2.98Å
51	M	93.1	Very high	88.2	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-72.2	-56.9	177.8	-172.6	173	67.3	0	0	112.1	I46 H47 E48 F49 F53 S54 L57 L67 F70 I75	I46-M51 HydrophobicContact CD1-CB 3.8Å; I46-M51 HydrophobicContact CD1-CG 4.22Å; I46-M51 HydrophobicContact CG1-CB 4.16Å; I46-M51 HydrophobicContact CG2-SD 4.36Å; H47-M51 PolarHBondContact O-N 2.96Å; E48-M51 WeakPolarHBondContact O-CA 3.49Å; E48-M51 VanDerWaalsContact O-CB 3.31Å; E48-M51 WeakPolarHBondContact O-CB 3.34Å; E48-M51 PolarHBondContact O-N 2.97Å; F49-M51 VanDerWaalsContact C-N 3.27Å; M51-F53 VanDerWaalsContact C-N 3.35Å; M51-F53 PolarHBondContact O-N 2.87Å; M51-S54 WeakPolarHBondContact O-CB 3.29Å; M51-S54 PolarHBondContact O-N 2.69Å; M51-S54 VanDerWaalsContact O-N 3.15Å; M51-L57 HydrophobicContact CG-CD1 4.03Å; M51-L67 VanDerWaalsContact CE-O 3.31Å; M51-L67 WeakPolarHBondContact CE-O 3.31Å; M51-L67 HydrophobicContact SD-CB 4.07Å; M51-F70 HydrophobicContact CE-CD2 3.41Å; M51-F70 VanDerWaalsContact CE-CD2 3.41Å; M51-F70 HydrophobicContact CE-CE2 3.79Å; M51-F70 HydrophobicContact CE-CG 4.22Å; M51-F70 HydrophobicContact CG-CB 4.22Å; M51-F70 HydrophobicContact CG-CD1 4.12Å; M51-F70 HydrophobicContact CG-CD2 3.77Å; M51-F70 HydrophobicContact CG-CE1 4.42Å; M51-F70 HydrophobicContact CG-CE2 4.1Å; M51-F70 HydrophobicContact CG-CG 3.76Å; M51-F70 HydrophobicContact CG-CZ 4.4Å; M51-F70 HydrophobicContact SD-CB 3.6Å; M51-F70 VanDerWaalsContact SD-CB 3.6Å; M51-F70 HydrophobicContact SD-CD1 4.5Å; M51-F70 HydrophobicContact SD-CD2 3.4Å; M51-F70 WeakPolarHBondContact SD-CD2 3.4Å; M51-F70 HydrophobicContact SD-CE2 4.17Å; M51-F70 HydrophobicContact SD-CG 3.58Å; M51-F70 VanDerWaalsContact SD-CG 3.58Å; M51-I75 HydrophobicContact CG-CD1 4.38Å; M51-I75 HydrophobicContact SD-CD1 4Å
52	Y	92	Very high	87.3	Confident	17 Å²	17	35 Å²	35	7%	0.067	20%	0.197	C	C	.	.	H	α-helix	trans	-60	-40.4	-173.1	-58.4	-31.4	0	0	0	114	E48 F49 M68 F70 Y124	E48-Y52 HydrophobicContact CB-CE2 3.95Å; E48-Y52 WeakPolarHBondContact O-CD2 3.31Å; E48-Y52 VanDerWaalsContact O-CG 3.31Å; E48-Y52 PolarHBondContact O-N 3.06Å; F49-Y52 AromaticContact CD1-CD2 3.91Å; F49-Y52 HydrophobicContact CD1-CD2 3.91Å; F49-Y52 HydrophobicContact CD1-CE2 4.24Å; F49-Y52 HydrophobicContact CE1-CD2 4.44Å; F49-Y52 HydrophobicContact CE1-CE2 4.42Å; Y52-M68 HydrophobicContact CE1-SD 4.41Å; Y52-M68 WeakPolarHBondContact OH-CE 3.42Å; Y52-M68 PolarHBondContact OH-SD 2.94Å; Y52-F70 AromaticContact CD1-CE2 3.82Å; Y52-F70 HydrophobicContact CD1-CE2 3.82Å; Y52-F70 HydrophobicContact CD1-CZ 4.16Å; Y52-F70 AromaticContact CE1-CE2 3.95Å; Y52-F70 HydrophobicContact CE1-CE2 3.95Å; Y52-Y124 HydrophobicContact CD2-CD1 4.39Å; Y52-Y124 AromaticContact CD2-CE1 3.83Å; Y52-Y124 HydrophobicContact CD2-CE1 3.83Å; Y52-Y124 HydrophobicContact CG-CD1 4.35Å; Y52-Y124 HydrophobicContact CG-CE1 4.08Å
53	F	95	Very high	86.3	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.009	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-7.6	-177.2	-70	-82.7	0	0	0	113.2	F49 M51 I97 F108 F118 E119 F120 Y124 K125 A126	F49-F53 HydrophobicContact CB-CD2 4.06Å; F49-F53 HydrophobicContact CB-CE2 4.26Å; F49-F53 HydrophobicContact CD1-CE2 4.44Å; F49-F53 WeakPolarHBondContact O-CD2 3.45Å; F49-F53 PolarHBondContact O-N 3.1Å; M51-F53 VanDerWaalsContact C-N 3.35Å; M51-F53 PolarHBondContact O-N 2.87Å; F53-I97 HydrophobicContact CB-CB 4.42Å; F53-I97 HydrophobicContact CB-CD1 3.71Å; F53-I97 HydrophobicContact CB-CG1 3.8Å; F53-I97 HydrophobicContact CB-CG2 3.79Å; F53-F108 AromaticContact CD2-CD2 3.86Å; F53-F108 HydrophobicContact CD2-CD2 3.86Å; F53-F108 AromaticContact CD2-CE2 3.73Å; F53-F108 HydrophobicContact CD2-CE2 3.73Å; F53-F108 HydrophobicContact CE2-CD2 4.3Å; F53-F108 AromaticContact CE2-CE2 3.68Å; F53-F108 HydrophobicContact CE2-CE2 3.68Å; F53-F108 HydrophobicContact CG-CD2 4.46Å; F53-F108 HydrophobicContact CZ-CE2 4.48Å; F53-F118 AromaticContact CD1-CD1 3.66Å; F53-F118 HydrophobicContact CD1-CD1 3.66Å; F53-F118 HydrophobicContact CD1-CE1 4.33Å; F53-F118 HydrophobicContact CD2-CD1 4.23Å; F53-F118 HydrophobicContact CE1-CB 3.82Å; F53-F118 AromaticContact CE1-CD1 3.63Å; F53-F118 HydrophobicContact CE1-CD1 3.63Å; F53-F118 HydrophobicContact CE1-CG 4.2Å; F53-F118 HydrophobicContact CE2-CB 4.45Å; F53-F118 HydrophobicContact CE2-CD1 4.2Å; F53-F118 AromaticContact CG-CD1 3.98Å; F53-F118 HydrophobicContact CG-CD1 3.98Å; F53-F118 HydrophobicContact CG-CE1 4.32Å; F53-F118 HydrophobicContact CZ-CB 3.68Å; F53-F118 AromaticContact CZ-CD1 3.91Å; F53-F118 HydrophobicContact CZ-CD1 3.91Å; F53-F118 HydrophobicContact CZ-CG 4.17Å; F53-E119 VanDerWaalsContact CE1-O 3.27Å; F53-E119 WeakPolarHBondContact CE1-O 3.21Å; F53-E119 WeakPolarHBondContact CZ-O 3.42Å; F53-F120 AromaticContact CE2-CD1 3.8Å; F53-F120 HydrophobicContact CE2-CD1 3.8Å; F53-F120 AromaticContact CE2-CE1 3.68Å; F53-F120 HydrophobicContact CE2-CE1 3.68Å; F53-F120 HydrophobicContact CE2-CZ 4.5Å; F53-F120 AromaticContact CZ-CD1 3.75Å; F53-F120 HydrophobicContact CZ-CD1 3.75Å; F53-F120 AromaticContact CZ-CE1 3.87Å; F53-F120 HydrophobicContact CZ-CE1 3.87Å; F53-F120 HydrophobicContact CZ-CG 4.24Å; F53-F120 HydrophobicContact CZ-CZ 4.45Å; F53-Y124 WeakPolarHBondContact CD1-O 2.94Å; F53-Y124 HydrophobicContact CD2-CD1 4.42Å; F53-Y124 HydrophobicContact CE1-CD1 4.09Å; F53-Y124 HydrophobicContact CE1-CG 4.47Å; F53-Y124 AromaticContact CE2-CD1 3.91Å; F53-Y124 HydrophobicContact CE2-CD1 3.91Å; F53-Y124 AromaticContact CZ-CD1 3.71Å; F53-Y124 HydrophobicContact CZ-CD1 3.71Å; F53-K125 WeakPolarHBondContact CE1-O 3.29Å; F53-A126 HydrophobicContact CD1-CB 4.11Å
54	S	94	Very high	85.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	-67.2	137.1	179.8	-80.1	0	0	0	0	111.2	F22 C50 M51 T96 R424	F22-S54 WeakPolarHBondContact CD2-OG 3.49Å; F22-S54 WeakPolarHBondContact CE2-OG 3.41Å; C50-S54 WeakPolarHBondContact O-CB 3.19Å; C50-S54 PolarHBondContact O-OG 2.98Å; M51-S54 WeakPolarHBondContact O-CB 3.29Å; M51-S54 PolarHBondContact O-N 2.69Å; M51-S54 VanDerWaalsContact O-N 3.15Å; S54-T96 WeakPolarHBondContact OG-CB 3.45Å; S54-T96 PolarHBondContact OG-OG1 2.7Å; S54-R424 PolarHBondContact O-NH1 3.44Å; S54-R424 PolarHBondContact O-NH2 2.97Å
55	E	87.7	Confident	84.1	Confident	69 Å²	69	38.7 Å²	38.7	32%	0.322	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	150.2	174.5	-153.8	176.1	162.8	0	0	111.2	L57 L78 T96 P98 H105 R424	E55-L57 PolarHBondContact O-N 3.05Å; E55-L78 WeakPolarHBondContact O-CD2 3.44Å; E55-T96 PolarHBondContact N-O 2.86Å; E55-P98 HydrophobicContact CB-CG 4.15Å; E55-P98 HydrophobicContact CG-CG 4.12Å; E55-H105 IonicContact OE2-CD2 3.84Å; E55-H105 IonicContact OE2-CE1 3.7Å; E55-H105 IonicContact OE2-NE2 2.81Å; E55-H105 PolarHBondContact OE2-NE2 3.33Å; E55-R424 VanDerWaalsContact C-NH1 3.32Å
56	T	83.1	Confident	83.2	Confident	89 Å²	89	41.7 Å²	41.7	55%	0.546	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	-9.6	173.1	71.8	0	0	0	0	118.5	V58 L78	T56-V58 PolarHBondContact O-N 3.19Å; T56-L78 VanDerWaalsContact OG1-CD1 3.23Å; T56-L78 WeakPolarHBondContact OG1-CD1 3.31Å
57	L	89.1	Confident	82.7	Confident	8 Å²	8	42 Å²	42	4%	0.042	25%	0.25	C	C	.	.			trans	-69.9	132.8	170.2	-65.2	-174.6	0	0	0	110.4	F22 M51 E55 F70 A74 I75 L78 R424	F22-L57 HydrophobicContact CE2-CD1 4.17Å; F22-L57 HydrophobicContact CZ-CD1 4.25Å; M51-L57 HydrophobicContact CG-CD1 4.03Å; E55-L57 PolarHBondContact O-N 3.05Å; L57-F70 HydrophobicContact CB-CD1 3.89Å; L57-F70 HydrophobicContact CB-CE1 3.79Å; L57-F70 HydrophobicContact CD1-CD1 4.43Å; L57-A74 HydrophobicContact CD2-CB 4.35Å; L57-I75 HydrophobicContact CD1-CG1 3.92Å; L57-I75 HydrophobicContact CD2-CG1 4.14Å; L57-L78 HydrophobicContact CD1-CD2 4.18Å; L57-L78 HydrophobicContact CD2-CB 4.36Å; L57-L78 HydrophobicContact CD2-CD2 3.78Å; L57-L78 HydrophobicContact CG-CD2 3.62Å; L57-R424 PolarHBondContact O-NH1 2.92Å
58	V	82.9	Confident	82.1	Confident	90 Å²	90	43.9 Å²	43.9	55%	0.545	26%	0.259	S	S	.	.			trans	-118.1	129.9	176.3	-179.6	0	0	0	0	107.5	T56	T56-V58 PolarHBondContact O-N 3.19Å
59	Q	81.5	Confident	81.7	Confident	19 Å²	19	43.9 Å²	43.9	9%	0.089	26%	0.261	C	S	.	.			trans	-77.5	133.1	174.3	-162.2	177	15.4	0	0	108.8	M68 F70 V422	Q59-M68 VanDerWaalsContact CG-O 3.28Å; Q59-M68 WeakPolarHBondContact CG-O 3.25Å; Q59-M68 PolarHBondContact NE2-O 2.93Å; Q59-F70 HydrophobicContact CB-CE1 4Å; Q59-F70 HydrophobicContact CB-CE2 3.97Å; Q59-F70 HydrophobicContact CB-CZ 3.7Å; Q59-F70 HydrophobicContact CG-CD2 4.12Å; Q59-F70 HydrophobicContact CG-CE2 3.75Å; Q59-F70 HydrophobicContact CG-CZ 4.03Å; Q59-V422 HydrophobicContact CB-CB 4.46Å
60	G	76.5	Confident	81.4	Confident	34 Å²	34	44.1 Å²	44.1	35%	0.351	26%	0.262	S	S	.	.			trans	-59.8	175.7	168.3	0	0	0	0	0	112	D62 G69	G60-D62 PolarHBondContact O-N 3.4Å; G60-G69 WeakPolarHBondContact CA-O 3.35Å; G60-G69 PolarHBondContact N-O 3.47Å
61	V	66.5	Low	81.1	Confident	121 Å²	121	47 Å²	47	73%	0.733	28%	0.283	S	S	*	.	S	Bend	trans	-72.6	-24.2	-179.8	-169.5	0	0	0	0	111.8
62	D	66.7	Low	81	Confident	69 Å²	69	47.3 Å²	47.3	37%	0.369	29%	0.285	S	S	.	.			trans	-116	111.9	-171.4	176.9	5.4	0	0	0	110.6	G60 T64 T65 G69	G60-D62 PolarHBondContact O-N 3.4Å; D62-T64 VanDerWaalsContact C-N 3.32Å; D62-T64 WeakPolarHBondContact OD1-CA 3.43Å; D62-T64 WeakPolarHBondContact OD1-CB 3.4Å; D62-T64 WeakPolarHBondContact OD1-CG2 3.35Å; D62-T64 PolarHBondContact OD1-N 2.93Å; D62-T64 PolarHBondContact OD1-OG1 3.2Å; D62-T64 PolarHBondContact OD2-OG1 3.44Å; D62-T64 VanDerWaalsContact OD2-OG1 3.1Å; D62-T65 HydrophobicContact CB-CG2 4.06Å; D62-T65 PolarHBondContact O-OG1 3.18Å; D62-T65 WeakPolarHBondContact OD2-CG2 3.38Å; D62-G69 WeakPolarHBondContact O-CA 3.31Å; D62-G69 PolarHBondContact O-N 3.32Å
63	D	65.3	Low	80.9	Confident	92 Å²	92	53 Å²	53	49%	0.492	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-5.3	177	63	-18.2	0	0	0	113.8	T65 M68	D63-T65 VanDerWaalsContact C-N 3.26Å; D63-M68 WeakPolarHBondContact O-CA 3.14Å
64	T	63.8	Low	80.7	Confident	118 Å²	118	54.7 Å²	54.7	72%	0.724	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-20.2	170.3	77.2	0	0	0	0	111.9	D62	D62-T64 VanDerWaalsContact C-N 3.32Å; D62-T64 WeakPolarHBondContact OD1-CA 3.43Å; D62-T64 WeakPolarHBondContact OD1-CB 3.4Å; D62-T64 WeakPolarHBondContact OD1-CG2 3.35Å; D62-T64 PolarHBondContact OD1-N 2.93Å; D62-T64 PolarHBondContact OD1-OG1 3.2Å; D62-T64 PolarHBondContact OD2-OG1 3.44Å; D62-T64 VanDerWaalsContact OD2-OG1 3.1Å
65	T	66.9	Low	80.7	Confident	55 Å²	55	54.7 Å²	54.7	34%	0.337	33%	0.325	S	S	.	.	S	Bend	trans	-66.4	154.3	174.9	63.3	0	0	0	0	111.7	D62 D63 L67 M68 G69	D62-T65 HydrophobicContact CB-CG2 4.06Å; D62-T65 PolarHBondContact O-OG1 3.18Å; D62-T65 WeakPolarHBondContact OD2-CG2 3.38Å; D63-T65 VanDerWaalsContact C-N 3.26Å; T65-L67 PolarHBondContact O-N 3.02Å; T65-M68 PolarHBondContact O-N 3.23Å; T65-G69 PolarHBondContact O-N 3.38Å; T65-G69 WeakPolarHBondContact OG1-CA 3.35Å; T65-G69 PolarHBondContact OG1-N 2.9Å; T65-G69 VanDerWaalsContact OG1-N 3.16Å
66	P	73.7	Confident	81	Confident	79 Å²	79	53.7 Å²	53.7	51%	0.513	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	142.4	178.4	-28.5	34.9	0	0	0	112.3	M68	P66-M68 PolarHBondContact O-N 3.35Å
67	L	84	Confident	81.5	Confident	7 Å²	7	57.6 Å²	57.6	4%	0.037	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	28.7	-175.8	-45.8	174.5	0	0	0	113.6	R37 D39 L44 I46 M51 T65 G69 F70 I75	R37-L67 HydrophobicContact CB-CD2 3.75Å; D39-L67 HydrophobicContact CB-CD1 3.67Å; D39-L67 HydrophobicContact CB-CD2 3.93Å; D39-L67 HydrophobicContact CB-CG 3.75Å; L44-L67 HydrophobicContact CD1-CD1 3.81Å; L44-L67 HydrophobicContact CD1-CD2 4.38Å; I46-L67 HydrophobicContact CG2-CD1 4.47Å; I46-L67 HydrophobicContact CG2-CD2 3.93Å; M51-L67 VanDerWaalsContact CE-O 3.31Å; M51-L67 WeakPolarHBondContact CE-O 3.31Å; M51-L67 HydrophobicContact SD-CB 4.07Å; T65-L67 PolarHBondContact O-N 3.02Å; L67-G69 PolarHBondContact O-N 2.93Å; L67-F70 HydrophobicContact CB-CB 4.36Å; L67-F70 WeakPolarHBondContact O-CD2 3.36Å; L67-F70 PolarHBondContact O-N 2.96Å; L67-I75 HydrophobicContact CD1-CD1 3.5Å
68	M	80.3	Confident	81.8	Confident	40 Å²	40	57.8 Å²	57.8	20%	0.197	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	44.1	173.4	-51.4	176.5	64	0	0	113.4	R37 Y52 Q59 D63 T65 P66	R37-M68 PolarHBondContact NH2-SD 3.03Å; R37-M68 VanDerWaalsContact NH2-SD 3.41Å; Y52-M68 HydrophobicContact CE1-SD 4.41Å; Y52-M68 WeakPolarHBondContact OH-CE 3.42Å; Y52-M68 PolarHBondContact OH-SD 2.94Å; Q59-M68 VanDerWaalsContact CG-O 3.28Å; Q59-M68 WeakPolarHBondContact CG-O 3.25Å; Q59-M68 PolarHBondContact NE2-O 2.93Å; D63-M68 WeakPolarHBondContact O-CA 3.14Å; T65-M68 PolarHBondContact O-N 3.23Å; P66-M68 PolarHBondContact O-N 3.35Å
69	G	84.4	Confident	82.3	Confident	8 Å²	8	53.5 Å²	53.5	8%	0.082	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	-10.6	-179.6	0	0	0	0	0	115.3	G60 D62 T65 L67	G60-G69 WeakPolarHBondContact CA-O 3.35Å; G60-G69 PolarHBondContact N-O 3.47Å; D62-G69 WeakPolarHBondContact O-CA 3.31Å; D62-G69 PolarHBondContact O-N 3.32Å; T65-G69 PolarHBondContact O-N 3.38Å; T65-G69 WeakPolarHBondContact OG1-CA 3.35Å; T65-G69 PolarHBondContact OG1-N 2.9Å; T65-G69 VanDerWaalsContact OG1-N 3.16Å; L67-G69 PolarHBondContact O-N 2.93Å
70	F	88.2	Confident	83	Confident	7 Å²	7	58.6 Å²	58.6	3%	0.031	33%	0.327	C	S	.	.			trans	-87.4	128.2	-179.2	-69.6	-86.4	0	0	0	111.8	M51 Y52 L57 Q59 L67 G72 I75	M51-F70 HydrophobicContact CE-CD2 3.41Å; M51-F70 VanDerWaalsContact CE-CD2 3.41Å; M51-F70 HydrophobicContact CE-CE2 3.79Å; M51-F70 HydrophobicContact CE-CG 4.22Å; M51-F70 HydrophobicContact CG-CB 4.22Å; M51-F70 HydrophobicContact CG-CD1 4.12Å; M51-F70 HydrophobicContact CG-CD2 3.77Å; M51-F70 HydrophobicContact CG-CE1 4.42Å; M51-F70 HydrophobicContact CG-CE2 4.1Å; M51-F70 HydrophobicContact CG-CG 3.76Å; M51-F70 HydrophobicContact CG-CZ 4.4Å; M51-F70 HydrophobicContact SD-CB 3.6Å; M51-F70 VanDerWaalsContact SD-CB 3.6Å; M51-F70 HydrophobicContact SD-CD1 4.5Å; M51-F70 HydrophobicContact SD-CD2 3.4Å; M51-F70 WeakPolarHBondContact SD-CD2 3.4Å; M51-F70 HydrophobicContact SD-CE2 4.17Å; M51-F70 HydrophobicContact SD-CG 3.58Å; M51-F70 VanDerWaalsContact SD-CG 3.58Å; Y52-F70 AromaticContact CD1-CE2 3.82Å; Y52-F70 HydrophobicContact CD1-CE2 3.82Å; Y52-F70 HydrophobicContact CD1-CZ 4.16Å; Y52-F70 AromaticContact CE1-CE2 3.95Å; Y52-F70 HydrophobicContact CE1-CE2 3.95Å; L57-F70 HydrophobicContact CB-CD1 3.89Å; L57-F70 HydrophobicContact CB-CE1 3.79Å; L57-F70 HydrophobicContact CD1-CD1 4.43Å; Q59-F70 HydrophobicContact CB-CE1 4Å; Q59-F70 HydrophobicContact CB-CE2 3.97Å; Q59-F70 HydrophobicContact CB-CZ 3.7Å; Q59-F70 HydrophobicContact CG-CD2 4.12Å; Q59-F70 HydrophobicContact CG-CE2 3.75Å; Q59-F70 HydrophobicContact CG-CZ 4.03Å; L67-F70 HydrophobicContact CB-CB 4.36Å; L67-F70 WeakPolarHBondContact O-CD2 3.36Å; L67-F70 PolarHBondContact O-N 2.96Å; F70-G72 PolarHBondContact O-N 3.46Å; F70-I75 HydrophobicContact CB-CD1 4.04Å
71	S	88.6	Confident	83.9	Confident	64 Å²	64	60.8 Å²	60.8	45%	0.448	34%	0.342	S	S	.	.			trans	-66.1	119.4	175.3	179.4	0	0	0	0	111.3	K73 A74 I75	S71-K73 PolarHBondContact O-N 2.82Å; S71-K73 PolarHBondContact OG-N 2.93Å; S71-A74 WeakPolarHBondContact O-CB 3.46Å; S71-A74 PolarHBondContact O-N 2.81Å; S71-I75 PolarHBondContact O-N 3.1Å
72	G	90	Very high	85.3	Confident	5 Å²	5	56.5 Å²	56.5	5%	0.052	31%	0.313	C	S	.	.	H	α-helix	trans	-55.6	-36.8	173	0	0	0	0	0	113.3	L42 F70 A74 I75 V76	L42-G72 VanDerWaalsContact CD1-C 3.43Å; F70-G72 PolarHBondContact O-N 3.46Å; G72-A74 PolarHBondContact O-N 3.34Å; G72-I75 WeakPolarHBondContact O-CB 3.2Å; G72-I75 PolarHBondContact O-N 3.11Å; G72-V76 WeakPolarHBondContact O-CG2 3.29Å; G72-V76 PolarHBondContact O-N 3.31Å
73	K	90.3	Very high	86.7	Confident	137 Å²	137	55.3 Å²	55.3	60%	0.596	31%	0.313	S	S	*	.	H	α-helix	trans	-62.1	-40.7	173.8	-65.8	-178.7	-178	173.8	0	112.1	L42 S71 V76 R77	L42-K73 HydrophobicContact CD1-CG 4.05Å; S71-K73 PolarHBondContact O-N 2.82Å; S71-K73 PolarHBondContact OG-N 2.93Å; K73-V76 PolarHBondContact O-N 2.73Å; K73-R77 VanDerWaalsContact O-CG 3.31Å; K73-R77 WeakPolarHBondContact O-CG 3.49Å; K73-R77 PolarHBondContact O-N 3.27Å
74	A	91.9	Very high	88.1	Confident	38 Å²	38	62.3 Å²	62.3	31%	0.314	33%	0.332	S	S	.	.	H	α-helix	trans	-66.3	-39.7	176.6	0	0	0	0	0	111.6	L57 S71 G72 R77 L78	L57-A74 HydrophobicContact CD2-CB 4.35Å; S71-A74 WeakPolarHBondContact O-CB 3.46Å; S71-A74 PolarHBondContact O-N 2.81Å; G72-A74 PolarHBondContact O-N 3.34Å; A74-R77 PolarHBondContact O-N 2.98Å; A74-L78 WeakPolarHBondContact O-CB 3.41Å; A74-L78 PolarHBondContact O-N 2.82Å
75	I	93.6	Very high	89.6	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-45.9	174.8	-72.6	162.5	0	0	0	111.3	V21 F22 I46 M51 L57 L67 F70 S71 G72 L78 A79	V21-I75 HydrophobicContact CG1-CG2 3.58Å; F22-I75 HydrophobicContact CE1-CG2 4.29Å; F22-I75 HydrophobicContact CZ-CG2 3.95Å; I46-I75 HydrophobicContact CD1-CD1 4.09Å; I46-I75 HydrophobicContact CD1-CG1 4.17Å; I46-I75 HydrophobicContact CD1-CG2 3.63Å; I46-I75 HydrophobicContact CG2-CD1 4.38Å; M51-I75 HydrophobicContact CG-CD1 4.38Å; M51-I75 HydrophobicContact SD-CD1 4Å; L57-I75 HydrophobicContact CD1-CG1 3.92Å; L57-I75 HydrophobicContact CD2-CG1 4.14Å; L67-I75 HydrophobicContact CD1-CD1 3.5Å; F70-I75 HydrophobicContact CB-CD1 4.04Å; S71-I75 PolarHBondContact O-N 3.1Å; G72-I75 WeakPolarHBondContact O-CB 3.2Å; G72-I75 PolarHBondContact O-N 3.11Å; I75-L78 PolarHBondContact O-N 3.32Å; I75-A79 WeakPolarHBondContact O-CB 3.49Å; I75-A79 PolarHBondContact O-N 2.62Å
76	V	93.6	Very high	91.1	Very high	48 Å²	48	67.1 Å²	67.1	29%	0.291	33%	0.334	S	S	.	.	H	α-helix	trans	-62.4	-49.7	177.7	173.4	0	0	0	0	111	L44 G72 K73 L78 A79 E80	L44-V76 HydrophobicContact CD2-CG2 4.15Å; G72-V76 WeakPolarHBondContact O-CG2 3.29Å; G72-V76 PolarHBondContact O-N 3.31Å; K73-V76 PolarHBondContact O-N 2.73Å; V76-L78 VanDerWaalsContact C-N 3.28Å; V76-L78 PolarHBondContact O-N 3.28Å; V76-A79 WeakPolarHBondContact O-CB 3.35Å; V76-A79 PolarHBondContact O-N 3.05Å; V76-E80 WeakPolarHBondContact O-CG 3.19Å; V76-E80 PolarHBondContact O-N 2.88Å
77	R	93.7	Very high	92.2	Very high	171 Å²	171	63.3 Å²	63.3	65%	0.645	31%	0.309	S	S	*	.	H	α-helix	trans	-56.1	-42.4	176.7	-72.5	173	-176.2	172.9	0.2	112	K73 A74 E80 A81	K73-R77 VanDerWaalsContact O-CG 3.31Å; K73-R77 WeakPolarHBondContact O-CG 3.49Å; K73-R77 PolarHBondContact O-N 3.27Å; A74-R77 PolarHBondContact O-N 2.98Å; R77-E80 PolarHBondContact O-N 3.32Å; R77-A81 WeakPolarHBondContact O-CB 3.42Å; R77-A81 PolarHBondContact O-N 3.19Å
78	L	94.9	Very high	92.9	Very high	11 Å²	11	64.6 Å²	64.6	6%	0.058	32%	0.315	C	S	.	.	H	α-helix	trans	-65	-41.9	176.7	-173.2	63.3	0	0	0	111.6	F22 E55 T56 L57 A74 I75 V76 E80 A81 F82 T96	F22-L78 HydrophobicContact CE1-CB 4.35Å; F22-L78 HydrophobicContact CE1-CD2 4.44Å; F22-L78 HydrophobicContact CE1-CG 4.4Å; F22-L78 HydrophobicContact CZ-CB 4.3Å; F22-L78 HydrophobicContact CZ-CD2 3.86Å; F22-L78 HydrophobicContact CZ-CG 4.27Å; E55-L78 WeakPolarHBondContact O-CD2 3.44Å; T56-L78 VanDerWaalsContact OG1-CD1 3.23Å; T56-L78 WeakPolarHBondContact OG1-CD1 3.31Å; L57-L78 HydrophobicContact CD1-CD2 4.18Å; L57-L78 HydrophobicContact CD2-CB 4.36Å; L57-L78 HydrophobicContact CD2-CD2 3.78Å; L57-L78 HydrophobicContact CG-CD2 3.62Å; A74-L78 WeakPolarHBondContact O-CB 3.41Å; A74-L78 PolarHBondContact O-N 2.82Å; I75-L78 PolarHBondContact O-N 3.32Å; V76-L78 VanDerWaalsContact C-N 3.28Å; V76-L78 PolarHBondContact O-N 3.28Å; L78-E80 VanDerWaalsContact C-N 3.26Å; L78-E80 PolarHBondContact O-N 3.39Å; L78-A81 PolarHBondContact O-N 3.41Å; L78-F82 HydrophobicContact CD1-CD2 3.46Å; L78-F82 VanDerWaalsContact CD1-CD2 3.46Å; L78-F82 HydrophobicContact CD1-CE2 3.38Å; L78-F82 HydrophobicContact CD1-CG 4.49Å; L78-F82 HydrophobicContact CD1-CZ 4.35Å; L78-F82 HydrophobicContact CG-CD2 4.16Å; L78-F82 HydrophobicContact CG-CE2 4.46Å; L78-F82 WeakPolarHBondContact O-CB 3.35Å; L78-F82 WeakPolarHBondContact O-CD2 3.32Å; L78-F82 PolarHBondContact O-N 3.28Å; L78-T96 HydrophobicContact CD2-CG2 4.2Å; L78-T96 HydrophobicContact CG-CG2 4.11Å
79	A	94.8	Very high	93.7	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-63.1	-34.7	178.7	0	0	0	0	0	112.2	V21 F22 I75 V76 A83	V21-A79 HydrophobicContact CG2-CB 3.79Å; F22-A79 HydrophobicContact CD1-CB 3.79Å; F22-A79 HydrophobicContact CE1-CB 3.62Å; I75-A79 WeakPolarHBondContact O-CB 3.49Å; I75-A79 PolarHBondContact O-N 2.62Å; V76-A79 WeakPolarHBondContact O-CB 3.35Å; V76-A79 PolarHBondContact O-N 3.05Å; A79-A83 PolarHBondContact O-N 3.28Å
80	E	95.2	Very high	94.3	Very high	125 Å²	125	67.5 Å²	67.5	58%	0.584	33%	0.329	S	S	*	.	H	α-helix	trans	-70.9	-49.8	174.4	-70.6	172.6	173	0	0	111.5	V76 R77 L78 F82 A83	V76-E80 WeakPolarHBondContact O-CG 3.19Å; V76-E80 PolarHBondContact O-N 2.88Å; R77-E80 PolarHBondContact O-N 3.32Å; L78-E80 VanDerWaalsContact C-N 3.26Å; L78-E80 PolarHBondContact O-N 3.39Å; E80-F82 PolarHBondContact O-N 3.24Å; E80-A83 WeakPolarHBondContact O-CB 3.42Å; E80-A83 PolarHBondContact O-N 3.46Å
81	A	95.2	Very high	94.7	Very high	80 Å²	80	73 Å²	73	66%	0.661	35%	0.353	S	S	*	.	H	α-helix	trans	-57.2	-37.4	177.2	0	0	0	0	0	112.1	R77 L78	R77-A81 WeakPolarHBondContact O-CB 3.42Å; R77-A81 PolarHBondContact O-N 3.19Å; L78-A81 PolarHBondContact O-N 3.41Å
82	F	96	Very high	95	Very high	32 Å²	32	76.1 Å²	76.1	14%	0.14	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	8.6	179.7	-77.8	-111	0	0	0	113.7	L78 E80 R84 K85 R94 A95 T96 H105	L78-F82 HydrophobicContact CD1-CD2 3.46Å; L78-F82 VanDerWaalsContact CD1-CD2 3.46Å; L78-F82 HydrophobicContact CD1-CE2 3.38Å; L78-F82 HydrophobicContact CD1-CG 4.49Å; L78-F82 HydrophobicContact CD1-CZ 4.35Å; L78-F82 HydrophobicContact CG-CD2 4.16Å; L78-F82 HydrophobicContact CG-CE2 4.46Å; L78-F82 WeakPolarHBondContact O-CB 3.35Å; L78-F82 WeakPolarHBondContact O-CD2 3.32Å; L78-F82 PolarHBondContact O-N 3.28Å; E80-F82 PolarHBondContact O-N 3.24Å; F82-R84 PolarHBondContact O-N 2.93Å; F82-K85 HydrophobicContact CB-CB 4.1Å; F82-K85 HydrophobicContact CD1-CB 3.62Å; F82-K85 HydrophobicContact CD1-CD 4.47Å; F82-K85 HydrophobicContact CD1-CG 3.68Å; F82-K85 HydrophobicContact CE1-CB 4.43Å; F82-K85 HydrophobicContact CE1-CD 4.5Å; F82-K85 HydrophobicContact CE1-CG 4.05Å; F82-K85 HydrophobicContact CG-CB 4.18Å; F82-K85 WeakPolarHBondContact O-CB 2.83Å; F82-K85 PolarHBondContact O-N 3.48Å; F82-R94 WeakPolarHBondContact O-CA 3.12Å; F82-R94 PolarHBondContact O-N 3.36Å; F82-A95 VanDerWaalsContact CD1-O 3.29Å; F82-A95 WeakPolarHBondContact CD1-O 3.14Å; F82-T96 HydrophobicContact CB-CG2 3.9Å; F82-T96 HydrophobicContact CD1-CG2 4.21Å; F82-T96 HydrophobicContact CG-CG2 3.99Å; F82-H105 AromaticContact CE1-CD2 3.63Å; F82-H105 AromaticContact CE1-NE2 3.68Å
83	A	95.5	Very high	95.3	Very high	44 Å²	44	77.1 Å²	77.1	36%	0.364	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-37.2	-177.4	0	0	0	0	0	113.2	A79 E80 G93	A79-A83 PolarHBondContact O-N 3.28Å; E80-A83 WeakPolarHBondContact O-CB 3.42Å; E80-A83 PolarHBondContact O-N 3.46Å; A83-G93 WeakPolarHBondContact O-CA 3.4Å
84	R	95.3	Very high	95.6	Very high	238 Å²	238	73.7 Å²	73.7	90%	0.898	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-4.6	178.5	-62.1	-177.9	-179	172.3	0.7	114.3	F82 R86	F82-R84 PolarHBondContact O-N 2.93Å; R84-R86 PolarHBondContact O-N 3Å
85	K	96.4	Very high	95.8	Very high	96 Å²	96	71.9 Å²	71.9	42%	0.417	34%	0.338	S	S	.	.			trans	-75.3	110.8	179.8	-164.4	81.2	170.3	-167.6	0	109.9	F82 G93 R94 A95 H105	F82-K85 HydrophobicContact CB-CB 4.1Å; F82-K85 HydrophobicContact CD1-CB 3.62Å; F82-K85 HydrophobicContact CD1-CD 4.47Å; F82-K85 HydrophobicContact CD1-CG 3.68Å; F82-K85 HydrophobicContact CE1-CB 4.43Å; F82-K85 HydrophobicContact CE1-CD 4.5Å; F82-K85 HydrophobicContact CE1-CG 4.05Å; F82-K85 HydrophobicContact CG-CB 4.18Å; F82-K85 WeakPolarHBondContact O-CB 2.83Å; F82-K85 PolarHBondContact O-N 3.48Å; K85-G93 CarbonylContact O-C 3.51Å; K85-G93 VanDerWaalsContact O-CA 3.29Å; K85-G93 WeakPolarHBondContact O-CA 3.45Å; K85-R94 PolarHBondContact O-N 3.04Å; K85-A95 PolarHBondContact O-N 2.75Å; K85-A95 VanDerWaalsContact O-N 3.16Å; K85-H105 WeakPolarHBondContact CE-CE1 3.24Å; K85-H105 WeakPolarHBondContact CE-ND1 3.35Å; K85-H105 HydrophobicContact CG-CB 4.16Å
86	R	97.4	Very high	95.9	Very high	178 Å²	178	72 Å²	72	67%	0.672	34%	0.338	S	S	*	.			trans	-83.5	134.2	-171.4	-66.2	-170.6	-70.2	170.8	-3.5	112.7	R84 K91 K92	R84-R86 PolarHBondContact O-N 3Å; R86-K91 WeakPolarHBondContact CD-O 3.44Å; R86-K91 VanDerWaalsContact CG-O 3.31Å; R86-K91 WeakPolarHBondContact CG-O 3.44Å; R86-K92 CarbonylContact C-O 3.52Å; R86-K92 WeakPolarHBondContact CA-O 3.31Å
87	C	97.9	Very high	96.1	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	33%	0.325	C	S	.	.			trans	-62.1	133.3	169.3	175.3	0	0	0	0	110.4	Y89 C90 K91 K92 A95 H107	C87-Y89 PolarHBondContact O-N 3.26Å; C87-Y89 VanDerWaalsContact O-N 3.16Å; C87-Y89 PolarHBondContact SG-N 3.49Å; C87-C90 WeakPolarHBondContact CB-SG 3.22Å; C87-C90 VanDerWaalsContact SG-SG 3.66Å; C87-K91 WeakPolarHBondContact O-CA 3.39Å; C87-K91 PolarHBondContact O-N 3.43Å; C87-K92 PolarHBondContact N-O 3.45Å; C87-A95 VanDerWaalsContact CA-CB 3.48Å; C87-A95 HydrophobicContact CB-CB 3.82Å; C87-H107 WeakPolarHBondContact CB-ND1 3.48Å
88	M	97.4	Very high	96.3	Very high	34 Å²	34	62.6 Å²	62.6	17%	0.167	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-24.7	-178.7	81	168.2	85.9	0	0	113.4	K91 R104 H105 F106 C128	M88-K91 WeakPolarHBondContact O-CE 3.45Å; M88-K91 PolarHBondContact O-NZ 2.86Å; M88-R104 HydrophobicContact CE-CB 3.44Å; M88-R104 VanDerWaalsContact CE-CB 3.44Å; M88-R104 HydrophobicContact SD-CB 4.47Å; M88-H105 PolarHBondContact N-O 3.29Å; M88-F106 HydrophobicContact CE-CD1 3.4Å; M88-F106 VanDerWaalsContact CE-CD1 3.4Å; M88-F106 HydrophobicContact CE-CE1 3.89Å; M88-F106 HydrophobicContact CE-CG 4.47Å; M88-C128 HydrophobicContact CE-CB 3.41Å; M88-C128 VanDerWaalsContact CE-CB 3.41Å; M88-C128 HydrophobicContact SD-CB 3.89Å
89	Y	97.2	Very high	96.4	Very high	58 Å²	58	62 Å²	62	23%	0.227	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-66	-178.2	-51.3	-71.4	0	0	0	111.5	C87 F106 C110 N111 S114 T129	C87-Y89 PolarHBondContact O-N 3.26Å; C87-Y89 VanDerWaalsContact O-N 3.16Å; C87-Y89 PolarHBondContact SG-N 3.49Å; Y89-F106 HydrophobicContact CD2-CB 3.84Å; Y89-F106 HydrophobicContact CE2-CB 3.74Å; Y89-F106 HydrophobicContact CE2-CD1 4.4Å; Y89-F106 HydrophobicContact CE2-CG 4.12Å; Y89-C110 HydrophobicContact CD2-CB 3.91Å; Y89-C110 HydrophobicContact CG-CB 4.43Å; Y89-N111 VanDerWaalsContact CE2-CA 3.42Å; Y89-N111 HydrophobicContact CE2-CB 3.76Å; Y89-N111 WeakPolarHBondContact CE2-OD1 3.33Å; Y89-N111 PolarHBondContact OH-OD1 2.91Å; Y89-S114 WeakPolarHBondContact CD1-OG 3.23Å; Y89-S114 WeakPolarHBondContact CE1-OG 3.48Å; Y89-T129 HydrophobicContact CE1-CG2 4.28Å; Y89-T129 PolarHBondContact OH-N 3.46Å
90	C	96.4	Very high	96.5	Very high	50 Å²	50	64.7 Å²	64.7	34%	0.338	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-7.4	-174.4	75.3	0	0	0	0	114.8	C87 K92 H107	C87-C90 WeakPolarHBondContact CB-SG 3.22Å; C87-C90 VanDerWaalsContact SG-SG 3.66Å; C90-K92 PolarHBondContact O-N 3.02Å; C90-H107 PolarHBondContact SG-ND1 3.37Å; C90-H107 VanDerWaalsContact SG-ND1 3.38Å
91	K	96.8	Very high	96.5	Very high	124 Å²	124	66 Å²	66	54%	0.539	32%	0.32	S	S	.	.			trans	61.8	0.3	-178.5	-47.6	-54.7	-174.6	-171.4	0	116.4	R86 C87 M88	R86-K91 WeakPolarHBondContact CD-O 3.44Å; R86-K91 VanDerWaalsContact CG-O 3.31Å; R86-K91 WeakPolarHBondContact CG-O 3.44Å; C87-K91 WeakPolarHBondContact O-CA 3.39Å; C87-K91 PolarHBondContact O-N 3.43Å; M88-K91 WeakPolarHBondContact O-CE 3.45Å; M88-K91 PolarHBondContact O-NZ 2.86Å
92	K	96.3	Very high	96.6	Very high	128 Å²	128	64 Å²	64	56%	0.557	30%	0.3	S	S	*	.			trans	-71.7	155	173.1	-58.8	178.5	-176.9	175.9	0	111.2	R86 C87 C90	R86-K92 CarbonylContact C-O 3.52Å; R86-K92 WeakPolarHBondContact CA-O 3.31Å; C87-K92 PolarHBondContact N-O 3.45Å; C90-K92 PolarHBondContact O-N 3.02Å
93	G	95.9	Very high	96.6	Very high	27 Å²	27	67.7 Å²	67.7	28%	0.278	32%	0.322	S	S	.	.	S	Bend	trans	-69	-177.9	179.2	0	0	0	0	0	114.3	A83 K85 A95 H107	A83-G93 WeakPolarHBondContact O-CA 3.4Å; K85-G93 CarbonylContact O-C 3.51Å; K85-G93 VanDerWaalsContact O-CA 3.29Å; K85-G93 WeakPolarHBondContact O-CA 3.45Å; G93-A95 PolarHBondContact O-N 2.65Å; G93-H107 PolarHBondContact O-CE1 3.36Å; G93-H107 PolarHBondContact O-NE2 2.97Å
94	R	95.4	Very high	96.7	Very high	65 Å²	65	72 Å²	72	25%	0.245	33%	0.329	C	S	.	.			trans	60.4	30.7	177.8	-55.9	179.2	-175.7	-122.1	-8.5	114.1	V21 F22 F82 K85 T96 H107	V21-R94 VanDerWaalsContact O-CD 3.31Å; V21-R94 WeakPolarHBondContact O-CD 3.18Å; V21-R94 PolarHBondContact O-NH1 2.94Å; F22-R94 VanDerWaalsContact O-CB 3.24Å; F22-R94 WeakPolarHBondContact O-CB 3.22Å; F82-R94 WeakPolarHBondContact O-CA 3.12Å; F82-R94 PolarHBondContact O-N 3.36Å; K85-R94 PolarHBondContact O-N 3.04Å; R94-T96 PolarHBondContact O-N 2.8Å; R94-H107 PolarHBondContact O-NE2 3.26Å
95	A	96.4	Very high	96.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.289	C	S	.	.			trans	-79.3	96.3	171	0	0	0	0	0	109.1	F82 K85 C87 G93 H105	F82-A95 VanDerWaalsContact CD1-O 3.29Å; F82-A95 WeakPolarHBondContact CD1-O 3.14Å; K85-A95 PolarHBondContact O-N 2.75Å; K85-A95 VanDerWaalsContact O-N 3.16Å; C87-A95 VanDerWaalsContact CA-CB 3.48Å; C87-A95 HydrophobicContact CB-CB 3.82Å; G93-A95 PolarHBondContact O-N 2.65Å; A95-H105 HydrophobicContact CB-CB 3.9Å; A95-H105 WeakPolarHBondContact O-CB 2.98Å; A95-H105 PolarHBondContact O-CD2 3.31Å
96	T	96.4	Very high	96.9	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.012	27%	0.269	C	S	.	.			trans	-95	-10.1	-172.4	50.3	0	0	0	0	114	F22 S54 E55 L78 F82 R94 P98	F22-T96 HydrophobicContact CD1-CG2 3.79Å; F22-T96 HydrophobicContact CD2-CG2 4.35Å; F22-T96 HydrophobicContact CE1-CG2 3.87Å; F22-T96 HydrophobicContact CE2-CG2 4.41Å; F22-T96 HydrophobicContact CG-CG2 4.07Å; F22-T96 HydrophobicContact CZ-CG2 4.21Å; S54-T96 WeakPolarHBondContact OG-CB 3.45Å; S54-T96 PolarHBondContact OG-OG1 2.7Å; E55-T96 PolarHBondContact N-O 2.86Å; L78-T96 HydrophobicContact CD2-CG2 4.2Å; L78-T96 HydrophobicContact CG-CG2 4.11Å; F82-T96 HydrophobicContact CB-CG2 3.9Å; F82-T96 HydrophobicContact CD1-CG2 4.21Å; F82-T96 HydrophobicContact CG-CG2 3.99Å; R94-T96 PolarHBondContact O-N 2.8Å; T96-P98 WeakPolarHBondContact O-CD 3.38Å
97	I	97.3	Very high	96.9	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	114.5	-176.1	-56	170.9	0	0	0	109.6	F53 H105 F106 F108 F118 A126	F53-I97 HydrophobicContact CB-CB 4.42Å; F53-I97 HydrophobicContact CB-CD1 3.71Å; F53-I97 HydrophobicContact CB-CG1 3.8Å; F53-I97 HydrophobicContact CB-CG2 3.79Å; I97-H105 CarbonylContact O-C 3.6Å; I97-H105 WeakPolarHBondContact O-CA 3.45Å; I97-F106 HydrophobicContact CB-CD2 3.99Å; I97-F106 HydrophobicContact CB-CE2 3.96Å; I97-F106 WeakPolarHBondContact CB-O 3.22Å; I97-F106 HydrophobicContact CG2-CD2 3.96Å; I97-F106 HydrophobicContact CG2-CE2 3.38Å; I97-F106 HydrophobicContact CG2-CZ 3.92Å; I97-F106 PolarHBondContact N-O 2.9Å; I97-F106 PolarHBondContact O-N 3.31Å; I97-F108 HydrophobicContact CD1-CB 3.66Å; I97-F108 HydrophobicContact CD1-CD2 4.2Å; I97-F108 HydrophobicContact CD1-CG 4.46Å; I97-F118 HydrophobicContact CG2-CE1 4.41Å; I97-A126 HydrophobicContact CG2-CB 3.57Å
98	P	97.6	Very high	96.8	Very high	20 Å²	20	48.8 Å²	48.8	13%	0.13	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	148.6	176.5	31.7	-32	0	0	0	111.8	E55 T96 S100	E55-P98 HydrophobicContact CB-CG 4.15Å; E55-P98 HydrophobicContact CG-CG 4.12Å; T96-P98 WeakPolarHBondContact O-CD 3.38Å; P98-S100 PolarHBondContact O-N 3.15Å
99	C	98.1	Very high	96.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.243	C	C	.	.			trans	-68.9	125.6	159.4	179.8	0	0	0	0	109.6	F101 C102 N103 R104 F106 A126 C128	C99-F101 PolarHBondContact O-N 3.38Å; C99-C102 VanDerWaalsContact CB-SG 3.6Å; C99-N103 WeakPolarHBondContact O-CA 3.4Å; C99-N103 PolarHBondContact O-N 2.76Å; C99-N103 PolarHBondContact O-OD1 2.53Å; C99-R104 PolarHBondContact N-O 2.81Å; C99-F106 HydrophobicContact CB-CE1 3.96Å; C99-A126 CarbonylContact C-O 3.5Å; C99-A126 VanDerWaalsContact CA-O 3.31Å; C99-A126 WeakPolarHBondContact CA-O 3.23Å; C99-C128 HydrophobicContact CB-CB 4.29Å; C99-C128 PolarHBondContact SG-N 3.48Å
100	S	96.4	Very high	96.5	Very high	56 Å²	56	47.1 Å²	47.1	39%	0.392	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-9.7	179.9	-56.4	0	0	0	0	115	P98 K125 A126	P98-S100 PolarHBondContact O-N 3.15Å; S100-K125 WeakPolarHBondContact OG-CB 3.47Å; S100-A126 PolarHBondContact N-O 3.49Å; S100-A126 PolarHBondContact OG-N 2.92Å; S100-A126 PolarHBondContact OG-O 3.1Å
101	F	96.2	Very high	96.5	Very high	153 Å²	153	44.7 Å²	44.7	67%	0.671	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108	-51.9	177.1	-169.6	-91.5	0	0	0	112.6	C99 H131	C99-F101 PolarHBondContact O-N 3.38Å; F101-H131 HydrophobicContact CB-CB 3.94Å; F101-H131 AromaticContact CD1-CD2 3.22Å; F101-H131 WeakPolarHBondContact CD1-CD2 3.46Å; F101-H131 AromaticContact CD1-CE1 3.69Å; F101-H131 AromaticContact CD1-CG 3.64Å; F101-H131 AromaticContact CD1-ND1 3.88Å; F101-H131 AromaticContact CD1-NE2 3.27Å; F101-H131 VanDerWaalsContact CD1-NE2 3.27Å; F101-H131 WeakPolarHBondContact CD1-NE2 3.31Å; F101-H131 AromaticContact CE1-CD2 3.69Å; F101-H131 AromaticContact CE1-NE2 3.58Å; F101-H131 HydrophobicContact CG-CB 4.42Å; F101-H131 AromaticContact CG-CD2 3.88Å; F101-H131 AromaticContact CG-CG 3.99Å
102	C	97.1	Very high	96.4	Very high	38 Å²	38	42.2 Å²	42.2	26%	0.257	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	2.2	-173.7	70.7	0	0	0	0	115.7	C99 R104 H131	C99-C102 VanDerWaalsContact CB-SG 3.6Å; C102-R104 PolarHBondContact O-N 2.91Å; C102-H131 WeakPolarHBondContact CB-CE1 3.16Å; C102-H131 PolarHBondContact SG-ND1 2.86Å; C102-H131 VanDerWaalsContact SG-ND1 3.41Å
103	N	95.7	Very high	96.2	Very high	109 Å²	109	41.2 Å²	41.2	58%	0.583	22%	0.223	S	C	*	.			trans	53.7	20	178.5	-65.4	-33.4	0	0	0	115.3	C99 H105	C99-N103 WeakPolarHBondContact O-CA 3.4Å; C99-N103 PolarHBondContact O-N 2.76Å; C99-N103 PolarHBondContact O-OD1 2.53Å; N103-H105 PolarHBondContact O-CE1 2.93Å; N103-H105 VanDerWaalsContact O-CE1 3.22Å; N103-H105 PolarHBondContact O-ND1 3.3Å; N103-H105 VanDerWaalsContact O-ND1 3.09Å
104	R	97.3	Very high	96.1	Very high	136 Å²	136	42.4 Å²	42.4	51%	0.513	23%	0.227	S	C	.	.			trans	-80.3	137.8	168.6	-64.9	-175.2	-155.8	172	4.3	109.3	M88 C99 C102	M88-R104 HydrophobicContact CE-CB 3.44Å; M88-R104 VanDerWaalsContact CE-CB 3.44Å; M88-R104 HydrophobicContact SD-CB 4.47Å; C99-R104 PolarHBondContact N-O 2.81Å; C102-R104 PolarHBondContact O-N 2.91Å
105	H	97.7	Very high	96	Very high	12 Å²	12	40.3 Å²	40.3	6%	0.056	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	153.9	-174.6	-62.4	66.7	0	0	0	113.9	E55 F82 K85 M88 A95 I97 N103	E55-H105 IonicContact OE2-CD2 3.84Å; E55-H105 IonicContact OE2-CE1 3.7Å; E55-H105 IonicContact OE2-NE2 2.81Å; E55-H105 PolarHBondContact OE2-NE2 3.33Å; F82-H105 AromaticContact CE1-CD2 3.63Å; F82-H105 AromaticContact CE1-NE2 3.68Å; K85-H105 WeakPolarHBondContact CE-CE1 3.24Å; K85-H105 WeakPolarHBondContact CE-ND1 3.35Å; K85-H105 HydrophobicContact CG-CB 4.16Å; M88-H105 PolarHBondContact N-O 3.29Å; A95-H105 HydrophobicContact CB-CB 3.9Å; A95-H105 WeakPolarHBondContact O-CB 2.98Å; A95-H105 PolarHBondContact O-CD2 3.31Å; I97-H105 CarbonylContact O-C 3.6Å; I97-H105 WeakPolarHBondContact O-CA 3.45Å; N103-H105 PolarHBondContact O-CE1 2.93Å; N103-H105 VanDerWaalsContact O-CE1 3.22Å; N103-H105 PolarHBondContact O-ND1 3.3Å; N103-H105 VanDerWaalsContact O-ND1 3.09Å
106	F	97.8	Very high	96	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	167.4	178.2	43.2	-93.4	0	0	0	111.8	M88 Y89 I97 C99 N111 F118 A126 C128	M88-F106 HydrophobicContact CE-CD1 3.4Å; M88-F106 VanDerWaalsContact CE-CD1 3.4Å; M88-F106 HydrophobicContact CE-CE1 3.89Å; M88-F106 HydrophobicContact CE-CG 4.47Å; Y89-F106 HydrophobicContact CD2-CB 3.84Å; Y89-F106 HydrophobicContact CE2-CB 3.74Å; Y89-F106 HydrophobicContact CE2-CD1 4.4Å; Y89-F106 HydrophobicContact CE2-CG 4.12Å; I97-F106 HydrophobicContact CB-CD2 3.99Å; I97-F106 HydrophobicContact CB-CE2 3.96Å; I97-F106 WeakPolarHBondContact CB-O 3.22Å; I97-F106 HydrophobicContact CG2-CD2 3.96Å; I97-F106 HydrophobicContact CG2-CE2 3.38Å; I97-F106 HydrophobicContact CG2-CZ 3.92Å; I97-F106 PolarHBondContact N-O 2.9Å; I97-F106 PolarHBondContact O-N 3.31Å; C99-F106 HydrophobicContact CB-CE1 3.96Å; F106-N111 HydrophobicContact CB-CB 4.23Å; F106-N111 HydrophobicContact CD2-CB 3.22Å; F106-N111 HydrophobicContact CE2-CB 3.51Å; F106-N111 WeakPolarHBondContact CE2-ND2 3.24Å; F106-N111 HydrophobicContact CG-CB 3.74Å; F106-N111 HydrophobicContact CZ-CB 4.28Å; F106-F118 AromaticContact CE2-CE1 3.95Å; F106-F118 HydrophobicContact CE2-CE1 3.95Å; F106-F118 HydrophobicContact CE2-CZ 4.1Å; F106-A126 HydrophobicContact CE2-CB 3.91Å; F106-A126 HydrophobicContact CZ-CB 3.69Å; F106-C128 HydrophobicContact CE1-CB 4.39Å
107	H	96.8	Very high	96	Very high	11 Å²	11	40.6 Å²	40.6	5%	0.051	23%	0.228	C	C	.	.			trans	-84.2	152.6	162.6	-53.7	110.2	0	0	0	109.8	C23 C87 C90 G93 R94 C110 N111	C23-H107 HydrophobicContact CB-CB 4.29Å; C87-H107 WeakPolarHBondContact CB-ND1 3.48Å; C90-H107 PolarHBondContact SG-ND1 3.37Å; C90-H107 VanDerWaalsContact SG-ND1 3.38Å; G93-H107 PolarHBondContact O-CE1 3.36Å; G93-H107 PolarHBondContact O-NE2 2.97Å; R94-H107 PolarHBondContact O-NE2 3.26Å; H107-C110 HydrophobicContact CB-CB 4.09Å; H107-C110 PolarHBondContact O-N 2.83Å; H107-N111 PolarHBondContact O-N 2.79Å
108	F	95.7	Very high	96	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-55	-58.7	-178.3	-175	-87.4	0	0	0	111.8	G32 F49 F53 I97 C110 N111 R112 F118 F120	G32-F108 WeakPolarHBondContact O-CE1 3.43Å; F49-F108 HydrophobicContact CB-CD1 4.03Å; F49-F108 HydrophobicContact CB-CD2 3.45Å; F49-F108 VanDerWaalsContact CB-CD2 3.45Å; F49-F108 HydrophobicContact CB-CE1 4.01Å; F49-F108 HydrophobicContact CB-CE2 3.43Å; F49-F108 VanDerWaalsContact CB-CE2 3.43Å; F49-F108 HydrophobicContact CB-CG 3.76Å; F49-F108 HydrophobicContact CB-CZ 3.71Å; F49-F108 HydrophobicContact CD2-CD1 4.28Å; F49-F108 AromaticContact CD2-CE1 3.6Å; F49-F108 HydrophobicContact CD2-CE1 3.6Å; F49-F108 HydrophobicContact CD2-CE2 4.09Å; F49-F108 AromaticContact CD2-CZ 3.47Å; F49-F108 HydrophobicContact CD2-CZ 3.47Å; F49-F108 VanDerWaalsContact CD2-CZ 3.47Å; F49-F108 HydrophobicContact CE2-CZ 4.35Å; F49-F108 HydrophobicContact CG-CD2 4.43Å; F49-F108 HydrophobicContact CG-CE1 4.21Å; F49-F108 AromaticContact CG-CE2 3.95Å; F49-F108 HydrophobicContact CG-CE2 3.95Å; F49-F108 AromaticContact CG-CZ 3.82Å; F49-F108 HydrophobicContact CG-CZ 3.82Å; F53-F108 AromaticContact CD2-CD2 3.86Å; F53-F108 HydrophobicContact CD2-CD2 3.86Å; F53-F108 AromaticContact CD2-CE2 3.73Å; F53-F108 HydrophobicContact CD2-CE2 3.73Å; F53-F108 HydrophobicContact CE2-CD2 4.3Å; F53-F108 AromaticContact CE2-CE2 3.68Å; F53-F108 HydrophobicContact CE2-CE2 3.68Å; F53-F108 HydrophobicContact CG-CD2 4.46Å; F53-F108 HydrophobicContact CZ-CE2 4.48Å; I97-F108 HydrophobicContact CD1-CB 3.66Å; I97-F108 HydrophobicContact CD1-CD2 4.2Å; I97-F108 HydrophobicContact CD1-CG 4.46Å; F108-C110 VanDerWaalsContact C-N 3.29Å; F108-C110 PolarHBondContact O-N 3.27Å; F108-N111 PolarHBondContact O-N 2.72Å; F108-R112 PolarHBondContact O-N 3.34Å; F108-F118 AromaticContact CD2-CD1 3.97Å; F108-F118 HydrophobicContact CD2-CD1 3.97Å; F108-F118 HydrophobicContact CD2-CD2 4.48Å; F108-F118 AromaticContact CD2-CE1 3.42Å; F108-F118 HydrophobicContact CD2-CE1 3.42Å; F108-F118 VanDerWaalsContact CD2-CE1 3.42Å; F108-F118 HydrophobicContact CD2-CE2 4.02Å; F108-F118 HydrophobicContact CD2-CG 4.45Å; F108-F118 AromaticContact CD2-CZ 3.43Å; F108-F118 HydrophobicContact CD2-CZ 3.43Å; F108-F118 VanDerWaalsContact CD2-CZ 3.43Å; F108-F118 HydrophobicContact CE1-CE2 4.48Å; F108-F118 AromaticContact CE2-CD1 3.63Å; F108-F118 HydrophobicContact CE2-CD1 3.63Å; F108-F118 AromaticContact CE2-CD2 3.78Å; F108-F118 HydrophobicContact CE2-CD2 3.78Å; F108-F118 AromaticContact CE2-CE1 3.55Å; F108-F118 HydrophobicContact CE2-CE1 3.55Å; F108-F118 AromaticContact CE2-CE2 3.72Å; F108-F118 HydrophobicContact CE2-CE2 3.72Å; F108-F118 AromaticContact CE2-CG 3.73Å; F108-F118 HydrophobicContact CE2-CG 3.73Å; F108-F118 AromaticContact CE2-CZ 3.58Å; F108-F118 HydrophobicContact CE2-CZ 3.58Å; F108-F118 HydrophobicContact CG-CE1 4.37Å; F108-F118 HydrophobicContact CG-CZ 4.01Å; F108-F118 HydrophobicContact CZ-CD2 4.02Å; F108-F118 AromaticContact CZ-CE2 3.99Å; F108-F118 HydrophobicContact CZ-CE2 3.99Å; F108-F118 HydrophobicContact CZ-CG 4.33Å; F108-F118 HydrophobicContact CZ-CZ 4.26Å; F108-F120 HydrophobicContact CE2-CE1 4.26Å; F108-F120 HydrophobicContact CE2-CZ 4.34Å; F108-F120 HydrophobicContact CZ-CE1 4.08Å; F108-F120 AromaticContact CZ-CZ 3.96Å; F108-F120 HydrophobicContact CZ-CZ 3.96Å
109	G	93.9	Very high	95.9	Very high	24 Å²	24	40.5 Å²	40.5	25%	0.247	23%	0.226	C	C	.	.	H	α-helix	trans	-61.2	-33.7	-180	0	0	0	0	0	114	S113	G109-S113 WeakPolarHBondContact O-CB 3.27Å; G109-S113 PolarHBondContact O-N 3.43Å; G109-S113 PolarHBondContact O-OG 2.7Å
110	C	95.7	Very high	95.6	Very high	32 Å²	32	41.5 Å²	41.5	22%	0.216	23%	0.231	C	C	.	.	H	α-helix	trans	-64.7	-45.4	175.9	-74.3	0	0	0	0	112	Y89 H107 F108 S114	Y89-C110 HydrophobicContact CD2-CB 3.91Å; Y89-C110 HydrophobicContact CG-CB 4.43Å; H107-C110 HydrophobicContact CB-CB 4.09Å; H107-C110 PolarHBondContact O-N 2.83Å; F108-C110 VanDerWaalsContact C-N 3.29Å; F108-C110 PolarHBondContact O-N 3.27Å; C110-S114 WeakPolarHBondContact O-CB 3.49Å; C110-S114 PolarHBondContact O-N 3.31Å; C110-S114 PolarHBondContact O-OG 3.31Å
111	N	96.5	Very high	95.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68	-44	179.5	-171.2	56.7	0	0	0	111.9	Y89 F106 H107 F108 S113 S114 G115 G116 F118 Y127	Y89-N111 VanDerWaalsContact CE2-CA 3.42Å; Y89-N111 HydrophobicContact CE2-CB 3.76Å; Y89-N111 WeakPolarHBondContact CE2-OD1 3.33Å; Y89-N111 PolarHBondContact OH-OD1 2.91Å; F106-N111 HydrophobicContact CB-CB 4.23Å; F106-N111 HydrophobicContact CD2-CB 3.22Å; F106-N111 HydrophobicContact CE2-CB 3.51Å; F106-N111 WeakPolarHBondContact CE2-ND2 3.24Å; F106-N111 HydrophobicContact CG-CB 3.74Å; F106-N111 HydrophobicContact CZ-CB 4.28Å; H107-N111 PolarHBondContact O-N 2.79Å; F108-N111 PolarHBondContact O-N 2.72Å; N111-S113 PolarHBondContact O-N 3.35Å; N111-S114 PolarHBondContact O-N 2.82Å; N111-S114 VanDerWaalsContact O-N 3.14Å; N111-G115 PolarHBondContact O-N 3.46Å; N111-G116 PolarHBondContact O-N 2.91Å; N111-F118 HydrophobicContact CB-CE2 4.3Å; N111-F118 HydrophobicContact CB-CZ 3.85Å; N111-F118 WeakPolarHBondContact ND2-CZ 3.4Å; N111-Y127 PolarHBondContact ND2-O 3.35Å; N111-Y127 PolarHBondContact OD1-O 3.49Å
112	R	93.7	Very high	95	Very high	71 Å²	71	36.7 Å²	36.7	27%	0.268	22%	0.216	S	C	.	.	H	α-helix	trans	-56.7	-49.8	175.6	-178.2	176.9	176.8	150.2	-10.1	111.9	E31 G32 F108 S114 G115 F118	E31-R112 VanDerWaalsContact CG-NH2 3.31Å; E31-R112 PolarHBondContact O-NH1 3.26Å; E31-R112 PolarHBondContact O-NH2 3.34Å; E31-R112 IonicContact OE1-NH2 3.86Å; G32-R112 PolarHBondContact O-NH1 3.25Å; F108-R112 PolarHBondContact O-N 3.34Å; R112-S114 PolarHBondContact O-N 3.09Å; R112-G115 PolarHBondContact O-N 3.34Å; R112-G115 VanDerWaalsContact O-N 3.12Å; R112-F118 HydrophobicContact CB-CE2 4.16Å
113	S	92.2	Very high	94.5	Very high	108 Å²	108	39.9 Å²	39.9	76%	0.755	23%	0.227	S	C	*	.	H	α-helix	trans	-64.8	-22.8	-179.2	-54.7	0	0	0	0	113	G109 N111	G109-S113 WeakPolarHBondContact O-CB 3.27Å; G109-S113 PolarHBondContact O-N 3.43Å; G109-S113 PolarHBondContact O-OG 2.7Å; N111-S113 PolarHBondContact O-N 3.35Å
114	S	94	Very high	94.4	Very high	52 Å²	52	35.9 Å²	35.9	36%	0.364	20%	0.204	S	C	.	.	H	α-helix	trans	-87.9	-9.6	179.2	-54.8	0	0	0	0	113.3	Y89 C110 N111 R112 T129	Y89-S114 WeakPolarHBondContact CD1-OG 3.23Å; Y89-S114 WeakPolarHBondContact CE1-OG 3.48Å; C110-S114 WeakPolarHBondContact O-CB 3.49Å; C110-S114 PolarHBondContact O-N 3.31Å; C110-S114 PolarHBondContact O-OG 3.31Å; N111-S114 PolarHBondContact O-N 2.82Å; N111-S114 VanDerWaalsContact O-N 3.14Å; R112-S114 PolarHBondContact O-N 3.09Å; S114-T129 WeakPolarHBondContact O-CG2 3.39Å
115	G	93.6	Very high	94.3	Very high	21 Å²	21	32.9 Å²	32.9	22%	0.216	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.4	20.6	-174.6	0	0	0	0	0	114.4	N111 R112	N111-G115 PolarHBondContact O-N 3.46Å; R112-G115 PolarHBondContact O-N 3.34Å; R112-G115 VanDerWaalsContact O-N 3.12Å
116	G	96	Very high	94.3	Very high	6 Å²	6	32.4 Å²	32.4	6%	0.062	19%	0.193	C	C	.	.			trans	-75.8	165.8	167.8	0	0	0	0	0	112.3	N111 Y127	N111-G116 PolarHBondContact O-N 2.91Å; G116-Y127 CarbonylContact C-O 3.58Å; G116-Y127 VanDerWaalsContact CA-O 3.31Å; G116-Y127 WeakPolarHBondContact CA-O 2.9Å
117	A	96.3	Very high	94.3	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	159.8	-174.5	0	0	0	0	0	112.6	Y127 V132 M136 F161	A117-Y127 HydrophobicContact CB-CD2 4.39Å; A117-Y127 PolarHBondContact N-O 3.28Å; A117-Y127 PolarHBondContact O-N 2.99Å; A117-V132 HydrophobicContact CB-CB 4.24Å; A117-V132 HydrophobicContact CB-CG1 3.74Å; A117-V132 HydrophobicContact CB-CG2 3.78Å; A117-M136 HydrophobicContact CB-SD 3.67Å; A117-F161 HydrophobicContact CB-CE1 4.49Å; A117-F161 HydrophobicContact CB-CE2 3.98Å; A117-F161 HydrophobicContact CB-CZ 3.57Å
118	F	96.8	Very high	94.4	Very high	8 Å²	8	33 Å²	33	4%	0.035	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	141.8	-177.8	-64.1	-83.3	0	0	0	109.9	F53 I97 F106 F108 N111 R112 F120 K125 A126 G210	F53-F118 AromaticContact CD1-CD1 3.66Å; F53-F118 HydrophobicContact CD1-CD1 3.66Å; F53-F118 HydrophobicContact CD1-CE1 4.33Å; F53-F118 HydrophobicContact CD2-CD1 4.23Å; F53-F118 HydrophobicContact CE1-CB 3.82Å; F53-F118 AromaticContact CE1-CD1 3.63Å; F53-F118 HydrophobicContact CE1-CD1 3.63Å; F53-F118 HydrophobicContact CE1-CG 4.2Å; F53-F118 HydrophobicContact CE2-CB 4.45Å; F53-F118 HydrophobicContact CE2-CD1 4.2Å; F53-F118 AromaticContact CG-CD1 3.98Å; F53-F118 HydrophobicContact CG-CD1 3.98Å; F53-F118 HydrophobicContact CG-CE1 4.32Å; F53-F118 HydrophobicContact CZ-CB 3.68Å; F53-F118 AromaticContact CZ-CD1 3.91Å; F53-F118 HydrophobicContact CZ-CD1 3.91Å; F53-F118 HydrophobicContact CZ-CG 4.17Å; I97-F118 HydrophobicContact CG2-CE1 4.41Å; F106-F118 AromaticContact CE2-CE1 3.95Å; F106-F118 HydrophobicContact CE2-CE1 3.95Å; F106-F118 HydrophobicContact CE2-CZ 4.1Å; F108-F118 AromaticContact CD2-CD1 3.97Å; F108-F118 HydrophobicContact CD2-CD1 3.97Å; F108-F118 HydrophobicContact CD2-CD2 4.48Å; F108-F118 AromaticContact CD2-CE1 3.42Å; F108-F118 HydrophobicContact CD2-CE1 3.42Å; F108-F118 VanDerWaalsContact CD2-CE1 3.42Å; F108-F118 HydrophobicContact CD2-CE2 4.02Å; F108-F118 HydrophobicContact CD2-CG 4.45Å; F108-F118 AromaticContact CD2-CZ 3.43Å; F108-F118 HydrophobicContact CD2-CZ 3.43Å; F108-F118 VanDerWaalsContact CD2-CZ 3.43Å; F108-F118 HydrophobicContact CE1-CE2 4.48Å; F108-F118 AromaticContact CE2-CD1 3.63Å; F108-F118 HydrophobicContact CE2-CD1 3.63Å; F108-F118 AromaticContact CE2-CD2 3.78Å; F108-F118 HydrophobicContact CE2-CD2 3.78Å; F108-F118 AromaticContact CE2-CE1 3.55Å; F108-F118 HydrophobicContact CE2-CE1 3.55Å; F108-F118 AromaticContact CE2-CE2 3.72Å; F108-F118 HydrophobicContact CE2-CE2 3.72Å; F108-F118 AromaticContact CE2-CG 3.73Å; F108-F118 HydrophobicContact CE2-CG 3.73Å; F108-F118 AromaticContact CE2-CZ 3.58Å; F108-F118 HydrophobicContact CE2-CZ 3.58Å; F108-F118 HydrophobicContact CG-CE1 4.37Å; F108-F118 HydrophobicContact CG-CZ 4.01Å; F108-F118 HydrophobicContact CZ-CD2 4.02Å; F108-F118 AromaticContact CZ-CE2 3.99Å; F108-F118 HydrophobicContact CZ-CE2 3.99Å; F108-F118 HydrophobicContact CZ-CG 4.33Å; F108-F118 HydrophobicContact CZ-CZ 4.26Å; N111-F118 HydrophobicContact CB-CE2 4.3Å; N111-F118 HydrophobicContact CB-CZ 3.85Å; N111-F118 WeakPolarHBondContact ND2-CZ 3.4Å; R112-F118 HydrophobicContact CB-CE2 4.16Å; F118-F120 HydrophobicContact CB-CD2 4.43Å; F118-F120 HydrophobicContact CB-CE2 3.83Å; F118-F120 HydrophobicContact CB-CZ 3.91Å; F118-K125 CarbonylContact C-O 3.59Å; F118-K125 WeakPolarHBondContact CA-O 3.49Å; F118-A126 HydrophobicContact CD1-CB 3.6Å; F118-A126 HydrophobicContact CE1-CB 3.7Å; F118-G210 VanDerWaalsContact O-CA 3.24Å; F118-G210 WeakPolarHBondContact O-CA 3.42Å
119	E	95.7	Very high	94.4	Very high	11 Å²	11	34.8 Å²	34.8	5%	0.051	21%	0.206	C	C	.	.			trans	-99.9	115.4	167.3	-69.9	174.2	-169.7	0	0	108	F53 F121 Y124 K125 Y127 R135 M136	F53-E119 VanDerWaalsContact CE1-O 3.27Å; F53-E119 WeakPolarHBondContact CE1-O 3.21Å; F53-E119 WeakPolarHBondContact CZ-O 3.42Å; E119-F121 HydrophobicContact CB-CD1 4.24Å; E119-F121 HydrophobicContact CB-CE1 3.95Å; E119-F121 HydrophobicContact CB-CZ 4.14Å; E119-F121 HydrophobicContact CG-CE1 4.02Å; E119-F121 HydrophobicContact CG-CZ 3.93Å; E119-F121 PolarHBondContact O-N 3.2Å; E119-Y124 WeakPolarHBondContact O-CA 3.42Å; E119-K125 HydrophobicContact CB-CB 4.28Å; E119-K125 HydrophobicContact CG-CB 4.39Å; E119-K125 PolarHBondContact N-O 2.82Å; E119-Y127 HydrophobicContact CG-CE2 4.05Å; E119-Y127 WeakPolarHBondContact OE1-CE2 3.34Å; E119-Y127 PolarHBondContact OE1-OH 3.32Å; E119-R135 IonicContact OE1-CZ 3.73Å; E119-R135 IonicContact OE1-NH2 2.62Å; E119-R135 PolarHBondContact OE1-NH2 3.03Å; E119-M136 HydrophobicContact CB-CE 4.5Å; E119-M136 HydrophobicContact CG-CE 3.23Å
120	F	93.6	Very high	94.5	Very high	21 Å²	21	39 Å²	39	9%	0.092	22%	0.223	C	C	.	.			trans	-89.5	28.8	178.8	-62	-89.1	0	0	0	112.2	F49 F53 F108 F118 Y212	F49-F120 HydrophobicContact CD1-CD1 4.37Å; F49-F120 HydrophobicContact CD1-CE1 4.01Å; F49-F120 HydrophobicContact CD2-CE1 4.28Å; F49-F120 HydrophobicContact CE1-CD1 4.14Å; F49-F120 AromaticContact CE1-CE1 3.93Å; F49-F120 HydrophobicContact CE1-CE1 3.93Å; F49-F120 HydrophobicContact CE2-CE1 4.22Å; F49-F120 HydrophobicContact CG-CE1 4.21Å; F49-F120 HydrophobicContact CZ-CE1 4.06Å; F53-F120 AromaticContact CE2-CD1 3.8Å; F53-F120 HydrophobicContact CE2-CD1 3.8Å; F53-F120 AromaticContact CE2-CE1 3.68Å; F53-F120 HydrophobicContact CE2-CE1 3.68Å; F53-F120 HydrophobicContact CE2-CZ 4.5Å; F53-F120 AromaticContact CZ-CD1 3.75Å; F53-F120 HydrophobicContact CZ-CD1 3.75Å; F53-F120 AromaticContact CZ-CE1 3.87Å; F53-F120 HydrophobicContact CZ-CE1 3.87Å; F53-F120 HydrophobicContact CZ-CG 4.24Å; F53-F120 HydrophobicContact CZ-CZ 4.45Å; F108-F120 HydrophobicContact CE2-CE1 4.26Å; F108-F120 HydrophobicContact CE2-CZ 4.34Å; F108-F120 HydrophobicContact CZ-CE1 4.08Å; F108-F120 AromaticContact CZ-CZ 3.96Å; F108-F120 HydrophobicContact CZ-CZ 3.96Å; F118-F120 HydrophobicContact CB-CD2 4.43Å; F118-F120 HydrophobicContact CB-CE2 3.83Å; F118-F120 HydrophobicContact CB-CZ 3.91Å; F120-Y212 HydrophobicContact CB-CD2 3.88Å; F120-Y212 AromaticContact CD1-CD2 3.5Å; F120-Y212 HydrophobicContact CD1-CD2 3.5Å; F120-Y212 VanDerWaalsContact CD1-CD2 3.5Å; F120-Y212 HydrophobicContact CD1-CE2 4.36Å; F120-Y212 AromaticContact CD1-CG 3.95Å; F120-Y212 HydrophobicContact CD1-CG 3.95Å; F120-Y212 HydrophobicContact CE1-CD2 4.13Å; F120-Y212 HydrophobicContact CE1-CG 4.15Å; F120-Y212 AromaticContact CG-CD2 3.73Å; F120-Y212 HydrophobicContact CG-CD2 3.73Å; F120-Y212 HydrophobicContact CG-CG 4.21Å
121	F	90.2	Very high	94.6	Very high	61 Å²	61	40 Å²	40	27%	0.268	22%	0.224	S	C	.	.	S	Bend	trans	-144.9	163.2	-178	60.7	-91.8	0	0	0	109.7	E119 E123 Y124 V207 F420	E119-F121 HydrophobicContact CB-CD1 4.24Å; E119-F121 HydrophobicContact CB-CE1 3.95Å; E119-F121 HydrophobicContact CB-CZ 4.14Å; E119-F121 HydrophobicContact CG-CE1 4.02Å; E119-F121 HydrophobicContact CG-CZ 3.93Å; E119-F121 PolarHBondContact O-N 3.2Å; F121-E123 PolarHBondContact O-N 3.43Å; F121-Y124 PolarHBondContact O-N 2.94Å; F121-V207 HydrophobicContact CD1-CG1 3.71Å; F121-V207 HydrophobicContact CE1-CG1 4.22Å; F121-V207 HydrophobicContact CG-CG1 4.48Å; F121-F420 HydrophobicContact CB-CE2 4.46Å
122	G	88.4	Confident	94.6	Very high	47 Å²	47	40.3 Å²	40.3	49%	0.485	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	-121.6	179.2	0	0	0	0	0	112.4	Y124	G122-Y124 VanDerWaalsContact C-N 3.25Å; G122-Y124 WeakPolarHBondContact O-CD2 3.47Å; G122-Y124 PolarHBondContact O-N 3.34Å
123	E	87.9	Confident	94.7	Very high	106 Å²	106	37.8 Å²	37.8	50%	0.495	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	4.3	-175	-61.2	177.1	154.3	0	0	114.2	F121 K125	F121-E123 PolarHBondContact O-N 3.43Å; E123-K125 HydrophobicContact CB-CG 4.43Å; E123-K125 WeakPolarHBondContact OE2-CE 3.19Å; E123-K125 IonicContact OE2-NZ 3.05Å; E123-K125 PolarHBondContact OE2-NZ 2.96Å
124	Y	92.5	Very high	94.8	Very high	25 Å²	25	39.5 Å²	39.5	10%	0.098	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	62.6	-176.4	-74.4	-104.7	0	0	0	112.4	Y52 F53 E119 F121 G122 V422	Y52-Y124 HydrophobicContact CD2-CD1 4.39Å; Y52-Y124 AromaticContact CD2-CE1 3.83Å; Y52-Y124 HydrophobicContact CD2-CE1 3.83Å; Y52-Y124 HydrophobicContact CG-CD1 4.35Å; Y52-Y124 HydrophobicContact CG-CE1 4.08Å; F53-Y124 WeakPolarHBondContact CD1-O 2.94Å; F53-Y124 HydrophobicContact CD2-CD1 4.42Å; F53-Y124 HydrophobicContact CE1-CD1 4.09Å; F53-Y124 HydrophobicContact CE1-CG 4.47Å; F53-Y124 AromaticContact CE2-CD1 3.91Å; F53-Y124 HydrophobicContact CE2-CD1 3.91Å; F53-Y124 AromaticContact CZ-CD1 3.71Å; F53-Y124 HydrophobicContact CZ-CD1 3.71Å; E119-Y124 WeakPolarHBondContact O-CA 3.42Å; F121-Y124 PolarHBondContact O-N 2.94Å; G122-Y124 VanDerWaalsContact C-N 3.25Å; G122-Y124 WeakPolarHBondContact O-CD2 3.47Å; G122-Y124 PolarHBondContact O-N 3.34Å; Y124-V422 HydrophobicContact CD2-CG1 4.22Å; Y124-V422 HydrophobicContact CD2-CG2 3.47Å; Y124-V422 VanDerWaalsContact CD2-CG2 3.47Å; Y124-V422 HydrophobicContact CE2-CG2 3.22Å; Y124-V422 HydrophobicContact CG-CG2 4.49Å
125	K	95.7	Very high	94.8	Very high	73 Å²	73	44.3 Å²	44.3	32%	0.317	23%	0.225	S	C	.	.			trans	-77.2	145.4	-178.6	-68.7	179	-179.8	161.8	0	111.9	F53 S100 F118 E119 E123 Y127	F53-K125 WeakPolarHBondContact CE1-O 3.29Å; S100-K125 WeakPolarHBondContact OG-CB 3.47Å; F118-K125 CarbonylContact C-O 3.59Å; F118-K125 WeakPolarHBondContact CA-O 3.49Å; E119-K125 HydrophobicContact CB-CB 4.28Å; E119-K125 HydrophobicContact CG-CB 4.39Å; E119-K125 PolarHBondContact N-O 2.82Å; E123-K125 HydrophobicContact CB-CG 4.43Å; E123-K125 WeakPolarHBondContact OE2-CE 3.19Å; E123-K125 IonicContact OE2-NZ 3.05Å; E123-K125 PolarHBondContact OE2-NZ 2.96Å; K125-Y127 HydrophobicContact CB-CE2 4.07Å
126	A	97.5	Very high	94.9	Very high	2 Å²	2	43.5 Å²	43.5	2%	0.017	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143	177.2	0	0	0	0	0	110.9	F53 I97 C99 S100 F106 F118	F53-A126 HydrophobicContact CD1-CB 4.11Å; I97-A126 HydrophobicContact CG2-CB 3.57Å; C99-A126 CarbonylContact C-O 3.5Å; C99-A126 VanDerWaalsContact CA-O 3.31Å; C99-A126 WeakPolarHBondContact CA-O 3.23Å; S100-A126 PolarHBondContact N-O 3.49Å; S100-A126 PolarHBondContact OG-N 2.92Å; S100-A126 PolarHBondContact OG-O 3.1Å; F106-A126 HydrophobicContact CE2-CB 3.91Å; F106-A126 HydrophobicContact CZ-CB 3.69Å; F118-A126 HydrophobicContact CD1-CB 3.6Å; F118-A126 HydrophobicContact CE1-CB 3.7Å
127	Y	98	Very high	94.8	Very high	23 Å²	23	45.9 Å²	45.9	9%	0.09	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.9	-176.9	-54.1	-85.9	0	0	0	109.8	N111 G116 A117 E119 K125 H131 P133 R135 M136	N111-Y127 PolarHBondContact ND2-O 3.35Å; N111-Y127 PolarHBondContact OD1-O 3.49Å; G116-Y127 CarbonylContact C-O 3.58Å; G116-Y127 VanDerWaalsContact CA-O 3.31Å; G116-Y127 WeakPolarHBondContact CA-O 2.9Å; A117-Y127 HydrophobicContact CB-CD2 4.39Å; A117-Y127 PolarHBondContact N-O 3.28Å; A117-Y127 PolarHBondContact O-N 2.99Å; E119-Y127 HydrophobicContact CG-CE2 4.05Å; E119-Y127 WeakPolarHBondContact OE1-CE2 3.34Å; E119-Y127 PolarHBondContact OE1-OH 3.32Å; K125-Y127 HydrophobicContact CB-CE2 4.07Å; Y127-H131 WeakPolarHBondContact CB-O 3.49Å; Y127-H131 VanDerWaalsContact CD1-O 3.29Å; Y127-H131 WeakPolarHBondContact CD1-O 3.5Å; Y127-P133 HydrophobicContact CD1-CG 4.05Å; Y127-P133 HydrophobicContact CD2-CG 4.14Å; Y127-P133 HydrophobicContact CE1-CG 3.8Å; Y127-P133 HydrophobicContact CE2-CG 3.88Å; Y127-P133 HydrophobicContact CG-CG 4.22Å; Y127-R135 PolarHBondContact OH-NH2 2.84Å; Y127-M136 HydrophobicContact CD2-SD 4.41Å; Y127-M136 HydrophobicContact CE2-CE 4.14Å; Y127-M136 HydrophobicContact CE2-SD 4.45Å
128	C	97.6	Very high	94.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.			trans	-72	167	169.6	72.1	0	0	0	0	110.5	M88 C99 F106 N130 H131 V132	M88-C128 HydrophobicContact CE-CB 3.41Å; M88-C128 VanDerWaalsContact CE-CB 3.41Å; M88-C128 HydrophobicContact SD-CB 3.89Å; C99-C128 HydrophobicContact CB-CB 4.29Å; C99-C128 PolarHBondContact SG-N 3.48Å; F106-C128 HydrophobicContact CE1-CB 4.39Å; C128-N130 PolarHBondContact O-N 2.96Å; C128-H131 CarbonylContact O-C 3.57Å; C128-H131 PolarHBondContact O-N 3.4Å; C128-H131 PolarHBondContact SG-ND1 3.49Å; C128-V132 WeakPolarHBondContact O-CG2 3.35Å; C128-V132 PolarHBondContact O-N 2.56Å; C128-V132 VanDerWaalsContact O-N 3.11Å
129	T	95.8	Very high	94.4	Very high	38 Å²	38	52 Å²	52	23%	0.233	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-48.4	-37.5	-179.4	53.3	0	0	0	0	114	Y89 S114 R137	Y89-T129 HydrophobicContact CE1-CG2 4.28Å; Y89-T129 PolarHBondContact OH-N 3.46Å; S114-T129 WeakPolarHBondContact O-CG2 3.39Å; T129-R137 PolarHBondContact O-NH2 3.44Å
130	N	96.2	Very high	94.2	Very high	113 Å²	113	52.8 Å²	52.8	60%	0.604	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-78	-20.2	-178.7	-60.9	-18.8	0	0	0	113.9	C128	C128-N130 PolarHBondContact O-N 2.96Å
131	H	97.4	Very high	94.1	Very high	52 Å²	52	56.5 Å²	56.5	24%	0.241	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-120.7	15.5	-174.3	-60.6	120.4	0	0	0	113.4	F101 C102 Y127 C128 P133	F101-H131 HydrophobicContact CB-CB 3.94Å; F101-H131 AromaticContact CD1-CD2 3.22Å; F101-H131 WeakPolarHBondContact CD1-CD2 3.46Å; F101-H131 AromaticContact CD1-CE1 3.69Å; F101-H131 AromaticContact CD1-CG 3.64Å; F101-H131 AromaticContact CD1-ND1 3.88Å; F101-H131 AromaticContact CD1-NE2 3.27Å; F101-H131 VanDerWaalsContact CD1-NE2 3.27Å; F101-H131 WeakPolarHBondContact CD1-NE2 3.31Å; F101-H131 AromaticContact CE1-CD2 3.69Å; F101-H131 AromaticContact CE1-NE2 3.58Å; F101-H131 HydrophobicContact CG-CB 4.42Å; F101-H131 AromaticContact CG-CD2 3.88Å; F101-H131 AromaticContact CG-CG 3.99Å; C102-H131 WeakPolarHBondContact CB-CE1 3.16Å; C102-H131 PolarHBondContact SG-ND1 2.86Å; C102-H131 VanDerWaalsContact SG-ND1 3.41Å; Y127-H131 WeakPolarHBondContact CB-O 3.49Å; Y127-H131 VanDerWaalsContact CD1-O 3.29Å; Y127-H131 WeakPolarHBondContact CD1-O 3.5Å; C128-H131 CarbonylContact O-C 3.57Å; C128-H131 PolarHBondContact O-N 3.4Å; C128-H131 PolarHBondContact SG-ND1 3.49Å; H131-P133 WeakPolarHBondContact O-CD 3.46Å
132	V	96.6	Very high	94.2	Very high	7 Å²	7	53.8 Å²	53.8	4%	0.042	29%	0.286	C	S	.	.			trans	-55.2	127.2	168	176.6	0	0	0	0	108	A117 C128 M136 R137 F161	A117-V132 HydrophobicContact CB-CB 4.24Å; A117-V132 HydrophobicContact CB-CG1 3.74Å; A117-V132 HydrophobicContact CB-CG2 3.78Å; C128-V132 WeakPolarHBondContact O-CG2 3.35Å; C128-V132 PolarHBondContact O-N 2.56Å; C128-V132 VanDerWaalsContact O-N 3.11Å; V132-M136 HydrophobicContact CG1-CB 4.15Å; V132-R137 HydrophobicContact CG1-CG 4.37Å; V132-R137 PolarHBondContact O-NH1 2.87Å; V132-F161 HydrophobicContact CG1-CD2 3.87Å; V132-F161 HydrophobicContact CG1-CE2 3.71Å; V132-F161 HydrophobicContact CG1-CZ 4.3Å
133	P	96.2	Very high	94.2	Very high	19 Å²	19	53.6 Å²	53.6	12%	0.123	28%	0.284	C	S	.	.			trans	-65.1	148.4	178.7	-25.4	35.5	0	0	0	112.9	Y127 H131 R135 M136	Y127-P133 HydrophobicContact CD1-CG 4.05Å; Y127-P133 HydrophobicContact CD2-CG 4.14Å; Y127-P133 HydrophobicContact CE1-CG 3.8Å; Y127-P133 HydrophobicContact CE2-CG 3.88Å; Y127-P133 HydrophobicContact CG-CG 4.22Å; H131-P133 WeakPolarHBondContact O-CD 3.46Å; P133-R135 VanDerWaalsContact C-N 3.27Å; P133-R135 HydrophobicContact CB-CG 4Å; P133-R135 PolarHBondContact O-N 3.5Å; P133-M136 HydrophobicContact CB-CG 4.46Å; P133-M136 HydrophobicContact CG-SD 4.28Å; P133-M136 PolarHBondContact O-N 3.44Å; P133-M136 VanDerWaalsContact O-N 3.11Å
134	Q	94.5	Very high	94.3	Very high	144 Å²	144	55.4 Å²	55.4	67%	0.673	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-60.9	-34.4	177.5	-74.3	-65.1	0.7	0	0	113.1	M136 R137	Q134-M136 PolarHBondContact O-N 3.46Å; Q134-M136 VanDerWaalsContact O-N 3.1Å; Q134-R137 PolarHBondContact O-N 3.28Å
135	R	93.9	Very high	94.1	Very high	153 Å²	153	56.7 Å²	56.7	58%	0.577	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-58.4	-23.4	175.9	68.6	172.6	176.9	-78.7	-3	114.2	E119 Y127 P133	E119-R135 IonicContact OE1-CZ 3.73Å; E119-R135 IonicContact OE1-NH2 2.62Å; E119-R135 PolarHBondContact OE1-NH2 3.03Å; Y127-R135 PolarHBondContact OH-NH2 2.84Å; P133-R135 VanDerWaalsContact C-N 3.27Å; P133-R135 HydrophobicContact CB-CG 4Å; P133-R135 PolarHBondContact O-N 3.5Å
136	M	95.6	Very high	93.9	Very high	4 Å²	4	55 Å²	55	2%	0.02	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-90.6	-8.6	179.2	-65	-174.3	163.1	0	0	113.1	A117 E119 Y127 V132 P133 Q134 F161	A117-M136 HydrophobicContact CB-SD 3.67Å; E119-M136 HydrophobicContact CB-CE 4.5Å; E119-M136 HydrophobicContact CG-CE 3.23Å; Y127-M136 HydrophobicContact CD2-SD 4.41Å; Y127-M136 HydrophobicContact CE2-CE 4.14Å; Y127-M136 HydrophobicContact CE2-SD 4.45Å; V132-M136 HydrophobicContact CG1-CB 4.15Å; P133-M136 HydrophobicContact CB-CG 4.46Å; P133-M136 HydrophobicContact CG-SD 4.28Å; P133-M136 PolarHBondContact O-N 3.44Å; P133-M136 VanDerWaalsContact O-N 3.11Å; Q134-M136 PolarHBondContact O-N 3.46Å; Q134-M136 VanDerWaalsContact O-N 3.1Å; M136-F161 HydrophobicContact CB-CE2 4.26Å
137	R	95.1	Very high	93.8	Very high	55 Å²	55	57.3 Å²	57.3	21%	0.208	33%	0.329	C	S	.	.	S	Bend	trans	-94.5	149.6	176.2	-69.9	-175.1	166.8	96	0.7	109.8	T129 V132 Q134 S139 N160 F161	T129-R137 PolarHBondContact O-NH2 3.44Å; V132-R137 HydrophobicContact CG1-CG 4.37Å; V132-R137 PolarHBondContact O-NH1 2.87Å; Q134-R137 PolarHBondContact O-N 3.28Å; R137-S139 PolarHBondContact O-N 2.99Å; R137-N160 VanDerWaalsContact CD-OD1 3.27Å; R137-N160 WeakPolarHBondContact CD-OD1 3.26Å; R137-F161 HydrophobicContact CG-CB 4.41Å; R137-F161 HydrophobicContact CG-CD2 4.22Å
138	C	93.8	Very high	93.7	Very high	11 Å²	11	56.2 Å²	56.2	7%	0.074	33%	0.325	C	S	.	.			trans	-67.8	127.5	173	-165.4	0	0	0	0	109.9	S140 N160 Y163	C138-S140 VanDerWaalsContact C-N 3.27Å; C138-S140 PolarHBondContact O-N 3.04Å; C138-S140 PolarHBondContact SG-O 3.43Å; C138-S140 VanDerWaalsContact SG-O 3.38Å; C138-N160 WeakPolarHBondContact CB-O 3.42Å; C138-N160 PolarHBondContact N-O 3.43Å; C138-N160 PolarHBondContact O-ND2 3.34Å; C138-Y163 HydrophobicContact CB-CD2 3.8Å; C138-Y163 HydrophobicContact CB-CE2 3.48Å; C138-Y163 VanDerWaalsContact CB-CE2 3.48Å
139	S	90.5	Very high	93.6	Very high	128 Å²	128	57.8 Å²	57.8	90%	0.895	34%	0.335	S	S	*	.	S	Bend	trans	-74.7	-16	179.2	54.8	0	0	0	0	113.6	R137	R137-S139 PolarHBondContact O-N 2.99Å
140	S	91.1	Very high	93.5	Very high	27 Å²	27	57.8 Å²	57.8	19%	0.189	33%	0.333	C	S	.	.	S	Bend	trans	-118	147.3	-177.7	52.6	0	0	0	0	110.7	C138 Y163 K165 Y173	C138-S140 VanDerWaalsContact C-N 3.27Å; C138-S140 PolarHBondContact O-N 3.04Å; C138-S140 PolarHBondContact SG-O 3.43Å; C138-S140 VanDerWaalsContact SG-O 3.38Å; S140-Y163 VanDerWaalsContact O-CE2 3.31Å; S140-Y163 WeakPolarHBondContact O-CE2 3.38Å; S140-Y163 PolarHBondContact O-OH 3.02Å; S140-K165 WeakPolarHBondContact OG-CD 3.46Å; S140-Y173 PolarHBondContact OG-OH 3.25Å
141	T	91.5	Very high	93.5	Very high	98 Å²	98	54.3 Å²	54.3	60%	0.601	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-101.2	125.8	175.8	-55.5	0	0	0	0	108.9	R157	T141-R157 HydrophobicContact CG2-CB 4.46Å
142	P	92	Very high	93.4	Very high	4 Å²	4	57.2 Å²	57.2	3%	0.026	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-64.3	144.4	176.5	18	-23.2	0	0	0	111	T146 L155 R157 Y163 Y173	P142-T146 HydrophobicContact CB-CG2 3.84Å; P142-L155 HydrophobicContact CB-CD1 4.02Å; P142-L155 HydrophobicContact CG-CB 4.35Å; P142-L155 HydrophobicContact CG-CD1 3.96Å; P142-R157 HydrophobicContact CG-CG 4.18Å; P142-R157 WeakPolarHBondContact O-CD 3.45Å; P142-Y163 WeakPolarHBondContact CD-OH 3.46Å; P142-Y163 HydrophobicContact CG-CD1 4.45Å; P142-Y163 HydrophobicContact CG-CD2 4.2Å; P142-Y163 HydrophobicContact CG-CE1 4.21Å; P142-Y163 HydrophobicContact CG-CE2 3.98Å; P142-Y163 HydrophobicContact CG-CG 4.44Å; P142-Y173 HydrophobicContact CB-CD1 3.95Å; P142-Y173 HydrophobicContact CB-CD2 3.97Å; P142-Y173 HydrophobicContact CB-CE1 3.95Å; P142-Y173 HydrophobicContact CB-CE2 3.97Å; P142-Y173 HydrophobicContact CB-CG 3.95Å; P142-Y173 HydrophobicContact CG-CD1 4.09Å; P142-Y173 HydrophobicContact CG-CE1 4.2Å; P142-Y173 HydrophobicContact CG-CG 4.46Å
143	G	89.5	Confident	93.4	Very high	43 Å²	43	61.7 Å²	61.7	44%	0.443	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-61.7	166	174.5	0	0	0	0	0	112.4	G145 T146	G143-G145 PolarHBondContact O-N 3.45Å; G143-T146 PolarHBondContact N-OG1 3.04Å; G143-T146 VanDerWaalsContact N-OG1 3.1Å; G143-T146 WeakPolarHBondContact O-CB 3.41Å; G143-T146 PolarHBondContact O-N 3.15Å; G143-T146 PolarHBondContact O-OG1 3.42Å
144	L	88.4	Confident	93.2	Very high	144 Å²	144	67.9 Å²	67.9	75%	0.754	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	136.4	171.9	-174.2	66.3	0	0	0	110.4	T146 R157	L144-T146 VanDerWaalsContact C-N 3.27Å; L144-T146 PolarHBondContact O-N 3.04Å; L144-R157 VanDerWaalsContact CB-NH1 3.32Å; L144-R157 VanDerWaalsContact CD1-CZ 3.41Å; L144-R157 VanDerWaalsContact CD1-NH1 3.35Å
145	G	88.5	Confident	93.1	Very high	52 Å²	52	61.8 Å²	61.8	54%	0.536	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	6.6	-178.9	0	0	0	0	0	115.1	G143 S147	G143-G145 PolarHBondContact O-N 3.45Å; G145-S147 PolarHBondContact O-N 3Å
146	T	92.6	Very high	92.9	Very high	39 Å²	39	58.3 Å²	58.3	24%	0.239	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-68.4	122.1	175.5	-49.8	0	0	0	0	110.4	P142 G143 L144 L155 Y173	P142-T146 HydrophobicContact CB-CG2 3.84Å; G143-T146 PolarHBondContact N-OG1 3.04Å; G143-T146 VanDerWaalsContact N-OG1 3.1Å; G143-T146 WeakPolarHBondContact O-CB 3.41Å; G143-T146 PolarHBondContact O-N 3.15Å; G143-T146 PolarHBondContact O-OG1 3.42Å; L144-T146 VanDerWaalsContact C-N 3.27Å; L144-T146 PolarHBondContact O-N 3.04Å; T146-L155 HydrophobicContact CG2-CD1 3.86Å; T146-L155 PolarHBondContact O-N 3.36Å; T146-Y173 HydrophobicContact CG2-CD2 3.69Å; T146-Y173 HydrophobicContact CG2-CE2 4.42Å; T146-Y173 HydrophobicContact CG2-CG 4.25Å
147	S	94.7	Very high	92.5	Very high	50 Å²	50	63.5 Å²	63.5	35%	0.35	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-95.6	151.2	175	59.5	0	0	0	0	112.1	G145 T149 E153	G145-S147 PolarHBondContact O-N 3Å; S147-T149 PolarHBondContact O-N 3.02Å; S147-E153 CarbonylContact C-O 3.54Å; S147-E153 WeakPolarHBondContact CA-O 3.47Å
148	C	96.6	Very high	92.2	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-61.2	130.7	169.4	175.7	0	0	0	0	110.7	I150 C151 Y152 E153 L155 Y173 H175	C148-I150 PolarHBondContact O-N 3.36Å; C148-I150 PolarHBondContact SG-N 3.3Å; C148-C151 VanDerWaalsContact CB-SG 3.57Å; C148-C151 VanDerWaalsContact SG-SG 3.64Å; C148-Y152 WeakPolarHBondContact O-CA 3.33Å; C148-Y152 PolarHBondContact O-N 2.92Å; C148-E153 WeakPolarHBondContact CB-O 3.31Å; C148-E153 PolarHBondContact N-O 3.32Å; C148-L155 HydrophobicContact CB-CD2 3.93Å; C148-Y173 CarbonylContact C-O 3.52Å; C148-Y173 WeakPolarHBondContact CA-O 3.38Å; C148-H175 VanDerWaalsContact CB-CE1 3.47Å; C148-H175 WeakPolarHBondContact CB-CE1 3.37Å; C148-H175 VanDerWaalsContact CB-ND1 3.29Å; C148-H175 WeakPolarHBondContact CB-ND1 3.1Å; C148-H175 PolarHBondContact SG-N 3.49Å; C148-H175 PolarHBondContact SG-ND1 3.34Å
149	T	94.8	Very high	92	Very high	32 Å²	32	71.1 Å²	71.1	20%	0.196	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-8	179.6	59.2	0	0	0	0	114.7	S147 N172 Y173 M174	S147-T149 PolarHBondContact O-N 3.02Å; T149-N172 HydrophobicContact CG2-CB 3.75Å; T149-N172 WeakPolarHBondContact CG2-OD1 3.22Å; T149-Y173 PolarHBondContact N-O 2.91Å; T149-M174 WeakPolarHBondContact OG1-CG 3.38Å
150	I	95.1	Very high	92.2	Very high	39 Å²	39	67.4 Å²	67.4	20%	0.2	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-52.1	178	-62.8	169.6	0	0	0	110.8	C148 M174 C178 V179 M182 P194	C148-I150 PolarHBondContact O-N 3.36Å; C148-I150 PolarHBondContact SG-N 3.3Å; I150-M174 HydrophobicContact CD1-CB 4.15Å; I150-M174 HydrophobicContact CD1-CG 3.9Å; I150-M174 HydrophobicContact CD1-SD 3.63Å; I150-M174 HydrophobicContact CG1-CG 3.96Å; I150-M174 HydrophobicContact CG1-SD 3.94Å; I150-C178 HydrophobicContact CB-CB 3.94Å; I150-C178 HydrophobicContact CD1-CB 3.82Å; I150-C178 HydrophobicContact CG1-CB 4.47Å; I150-C178 HydrophobicContact CG2-CB 4Å; I150-V179 HydrophobicContact CD1-CG2 3.97Å; I150-M182 HydrophobicContact CD1-CE 4.34Å; I150-M182 HydrophobicContact CD1-SD 3.94Å; I150-P194 HydrophobicContact CG1-CG 4.21Å
151	C	95.6	Very high	92.3	Very high	39 Å²	39	66.8 Å²	66.8	26%	0.264	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-6.2	-175.7	69.2	0	0	0	0	114.8	C148 E153 H175 C178	C148-C151 VanDerWaalsContact CB-SG 3.57Å; C148-C151 VanDerWaalsContact SG-SG 3.64Å; C151-E153 HydrophobicContact CB-CG 4.47Å; C151-E153 PolarHBondContact O-N 2.92Å; C151-E153 VanDerWaalsContact O-N 3.09Å; C151-H175 VanDerWaalsContact SG-CE1 3.53Å; C151-H175 PolarHBondContact SG-ND1 3.12Å; C151-C178 VanDerWaalsContact SG-SG 3.69Å
152	Y	95.1	Very high	92.4	Very high	113 Å²	113	64.1 Å²	64.1	44%	0.443	35%	0.35	S	S	.	.			trans	60.6	11	-176.8	-54.9	-83.6	0	0	0	115.4	C148 I503	C148-Y152 WeakPolarHBondContact O-CA 3.33Å; C148-Y152 PolarHBondContact O-N 2.92Å; Y152-I503 HydrophobicContact CE2-CG2 4.45Å
153	E	95.6	Very high	92.6	Very high	101 Å²	101	64 Å²	64	47%	0.472	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-86.2	154.1	172.3	-60.4	172.5	174.6	0	0	111.5	S147 C148 C151 R177	S147-E153 CarbonylContact C-O 3.54Å; S147-E153 WeakPolarHBondContact CA-O 3.47Å; C148-E153 WeakPolarHBondContact CB-O 3.31Å; C148-E153 PolarHBondContact N-O 3.32Å; C151-E153 HydrophobicContact CB-CG 4.47Å; C151-E153 PolarHBondContact O-N 2.92Å; C151-E153 VanDerWaalsContact O-N 3.09Å; E153-R177 IonicContact OE2-CZ 3.8Å; E153-R177 IonicContact OE2-NH2 2.7Å; E153-R177 PolarHBondContact OE2-NH2 3.43Å
154	E	93	Very high	92.8	Very high	150 Å²	150	62.4 Å²	62.4	70%	0.701	33%	0.33	S	S	*	.	B	Isolated β-bridge	trans	-63.3	147.8	178.7	-66.1	-171.3	170.3	0	0	113.3	H175	E154-H175 PolarHBondContact O-CE1 3.2Å; E154-H175 PolarHBondContact O-NE2 3.4Å
155	L	93	Very high	93.1	Very high	15 Å²	15	58 Å²	58	8%	0.079	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-88.9	139.2	178.6	-61.2	166.5	0	0	0	111.3	P142 T146 C148 R157 Y173	P142-L155 HydrophobicContact CB-CD1 4.02Å; P142-L155 HydrophobicContact CG-CB 4.35Å; P142-L155 HydrophobicContact CG-CD1 3.96Å; T146-L155 HydrophobicContact CG2-CD1 3.86Å; T146-L155 PolarHBondContact O-N 3.36Å; C148-L155 HydrophobicContact CB-CD2 3.93Å; L155-R157 PolarHBondContact O-N 3.01Å; L155-Y173 HydrophobicContact CD1-CG 4.06Å
156	N	89.4	Confident	93.3	Very high	81 Å²	81	55.5 Å²	55.5	43%	0.433	28%	0.279	S	S	.	.			trans	-76.6	106.1	168.6	-177.3	0.5	0	0	0	110.1	L158 T162 Y163	N156-L158 VanDerWaalsContact C-N 3.29Å; N156-L158 PolarHBondContact O-N 3.18Å; N156-L158 WeakPolarHBondContact OD1-CB 3.31Å; N156-L158 PolarHBondContact OD1-N 3.24Å; N156-T162 PolarHBondContact O-OG1 2.97Å; N156-Y163 VanDerWaalsContact O-CD1 3.31Å; N156-Y163 WeakPolarHBondContact O-CD1 3.45Å; N156-Y163 WeakPolarHBondContact O-CE1 3.46Å
157	R	87.6	Confident	93.3	Very high	112 Å²	112	57 Å²	57	42%	0.423	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-9.7	-176	-52.8	-179.6	-68.3	164	5.2	114	T141 P142 L144 L155 D159	T141-R157 HydrophobicContact CG2-CB 4.46Å; P142-R157 HydrophobicContact CG-CG 4.18Å; P142-R157 WeakPolarHBondContact O-CD 3.45Å; L144-R157 VanDerWaalsContact CB-NH1 3.32Å; L144-R157 VanDerWaalsContact CD1-CZ 3.41Å; L144-R157 VanDerWaalsContact CD1-NH1 3.35Å; L155-R157 PolarHBondContact O-N 3.01Å; R157-D159 VanDerWaalsContact C-N 3.33Å
158	L	88	Confident	93.3	Very high	168 Å²	168	56.3 Å²	56.3	88%	0.88	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-22.1	-176.2	-60	177.6	0	0	0	112.8	N156	N156-L158 VanDerWaalsContact C-N 3.29Å; N156-L158 PolarHBondContact O-N 3.18Å; N156-L158 WeakPolarHBondContact OD1-CB 3.31Å; N156-L158 PolarHBondContact OD1-N 3.24Å
159	D	90.3	Very high	93	Very high	58 Å²	58	57.2 Å²	57.2	31%	0.31	29%	0.29	S	S	.	.			trans	-129.9	103.6	-179.3	-177.7	1.6	0	0	0	110	R157 F161 T162 Y163	R157-D159 VanDerWaalsContact C-N 3.33Å; D159-F161 PolarHBondContact O-N 2.81Å; D159-F161 VanDerWaalsContact OD1-CB 3.25Å; D159-F161 WeakPolarHBondContact OD1-CB 3.5Å; D159-F161 PolarHBondContact OD1-N 3.43Å; D159-T162 HydrophobicContact CB-CG2 3.76Å; D159-T162 PolarHBondContact O-N 3.28Å; D159-T162 PolarHBondContact O-OG1 2.88Å; D159-T162 WeakPolarHBondContact OD2-CG2 3.34Å; D159-Y163 WeakPolarHBondContact O-CE1 3.17Å
160	N	93.1	Very high	92.2	Very high	50 Å²	50	61.5 Å²	61.5	27%	0.267	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	2	179.1	71.1	-17.8	0	0	0	114.4	R137 C138 Y163	R137-N160 VanDerWaalsContact CD-OD1 3.27Å; R137-N160 WeakPolarHBondContact CD-OD1 3.26Å; C138-N160 WeakPolarHBondContact CB-O 3.42Å; C138-N160 PolarHBondContact N-O 3.43Å; C138-N160 PolarHBondContact O-ND2 3.34Å; N160-Y163 HydrophobicContact CB-CE1 4.34Å; N160-Y163 WeakPolarHBondContact CB-OH 3.27Å
161	F	94.2	Very high	91.7	Very high	14 Å²	14	68.4 Å²	68.4	6%	0.061	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-19.1	167.5	-168.1	-117.2	0	0	0	113	A117 V132 M136 R137 D159 Y163 R176	A117-F161 HydrophobicContact CB-CE1 4.49Å; A117-F161 HydrophobicContact CB-CE2 3.98Å; A117-F161 HydrophobicContact CB-CZ 3.57Å; V132-F161 HydrophobicContact CG1-CD2 3.87Å; V132-F161 HydrophobicContact CG1-CE2 3.71Å; V132-F161 HydrophobicContact CG1-CZ 4.3Å; M136-F161 HydrophobicContact CB-CE2 4.26Å; R137-F161 HydrophobicContact CG-CB 4.41Å; R137-F161 HydrophobicContact CG-CD2 4.22Å; D159-F161 PolarHBondContact O-N 2.81Å; D159-F161 VanDerWaalsContact OD1-CB 3.25Å; D159-F161 WeakPolarHBondContact OD1-CB 3.5Å; D159-F161 PolarHBondContact OD1-N 3.43Å; F161-Y163 VanDerWaalsContact C-N 3.31Å; F161-Y163 PolarHBondContact O-N 2.86Å; F161-R176 VanDerWaalsContact CZ-CZ 3.49Å; F161-R176 WeakPolarHBondContact O-CD 3.34Å
162	T	93.8	Very high	91.6	Very high	43 Å²	43	67.6 Å²	67.6	26%	0.264	33%	0.333	S	S	.	.	S	Bend	trans	-79.8	-11.9	-176.6	63.8	0	0	0	0	114.1	N156 D159 R176	N156-T162 PolarHBondContact O-OG1 2.97Å; D159-T162 HydrophobicContact CB-CG2 3.76Å; D159-T162 PolarHBondContact O-N 3.28Å; D159-T162 PolarHBondContact O-OG1 2.88Å; D159-T162 WeakPolarHBondContact OD2-CG2 3.34Å; T162-R176 WeakPolarHBondContact O-CB 3.36Å; T162-R176 PolarHBondContact O-N 3.01Å
163	Y	95.1	Very high	91.6	Very high	2 Å²	2	63.6 Å²	63.6	1%	0.008	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	162.8	-179.4	62.4	-98.2	0	0	0	111.2	C138 S140 P142 N156 D159 N160 F161 Y173 M174	C138-Y163 HydrophobicContact CB-CD2 3.8Å; C138-Y163 HydrophobicContact CB-CE2 3.48Å; C138-Y163 VanDerWaalsContact CB-CE2 3.48Å; S140-Y163 VanDerWaalsContact O-CE2 3.31Å; S140-Y163 WeakPolarHBondContact O-CE2 3.38Å; S140-Y163 PolarHBondContact O-OH 3.02Å; P142-Y163 WeakPolarHBondContact CD-OH 3.46Å; P142-Y163 HydrophobicContact CG-CD1 4.45Å; P142-Y163 HydrophobicContact CG-CD2 4.2Å; P142-Y163 HydrophobicContact CG-CE1 4.21Å; P142-Y163 HydrophobicContact CG-CE2 3.98Å; P142-Y163 HydrophobicContact CG-CG 4.44Å; N156-Y163 VanDerWaalsContact O-CD1 3.31Å; N156-Y163 WeakPolarHBondContact O-CD1 3.45Å; N156-Y163 WeakPolarHBondContact O-CE1 3.46Å; D159-Y163 WeakPolarHBondContact O-CE1 3.17Å; N160-Y163 HydrophobicContact CB-CE1 4.34Å; N160-Y163 WeakPolarHBondContact CB-OH 3.27Å; F161-Y163 VanDerWaalsContact C-N 3.31Å; F161-Y163 PolarHBondContact O-N 2.86Å; Y163-Y173 HydrophobicContact CD2-CD1 4.04Å; Y163-Y173 HydrophobicContact CE2-CD1 4.37Å; Y163-Y173 HydrophobicContact CE2-CE1 4.43Å; Y163-M174 CarbonylContact C-O 3.32Å; Y163-M174 VanDerWaalsContact CA-O 3.23Å; Y163-M174 WeakPolarHBondContact CA-O 3.47Å; Y163-M174 WeakPolarHBondContact CB-O 3.48Å
164	M	94.9	Very high	91.6	Very high	9 Å²	9	58.8 Å²	58.8	4%	0.044	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	153.2	-178.2	-59.3	-175.2	-52.6	0	0	110.5	Y173 M174 R176 V179 M206 A209 I211	M164-Y173 WeakPolarHBondContact O-CA 3.45Å; M164-M174 PolarHBondContact N-O 3.38Å; M164-M174 PolarHBondContact O-N 3.32Å; M164-R176 HydrophobicContact CE-CG 4.41Å; M164-R176 HydrophobicContact CG-CB 4.42Å; M164-R176 HydrophobicContact CG-CG 4.49Å; M164-R176 HydrophobicContact SD-CG 4.04Å; M164-V179 HydrophobicContact CE-CB 3.29Å; M164-V179 HydrophobicContact CE-CG1 3.48Å; M164-V179 VanDerWaalsContact CE-CG1 3.48Å; M164-V179 HydrophobicContact CE-CG2 3.41Å; M164-V179 VanDerWaalsContact CE-CG2 3.41Å; M164-M206 HydrophobicContact CE-SD 3.5Å; M164-M206 VanDerWaalsContact CE-SD 3.5Å; M164-M206 HydrophobicContact SD-SD 4.08Å; M164-A209 HydrophobicContact SD-CB 4.2Å; M164-I211 HydrophobicContact CE-CD1 3.65Å; M164-I211 HydrophobicContact CE-CG1 3.75Å; M164-I211 HydrophobicContact SD-CD1 3.95Å; M164-I211 HydrophobicContact SD-CG1 3.96Å
165	K	94	Very high	91.8	Very high	51 Å²	51	52.3 Å²	52.3	22%	0.222	27%	0.265	C	S	.	.			trans	-116	126.6	173.4	-176.2	-177.7	-178.7	-165	0	108	S140 D170 Y173	S140-K165 WeakPolarHBondContact OG-CD 3.46Å; K165-D170 VanDerWaalsContact CE-CA 3.46Å; K165-D170 WeakPolarHBondContact CE-O 3.09Å; K165-D170 WeakPolarHBondContact CE-OD1 3.49Å; K165-D170 PolarHBondContact NZ-O 2.75Å; K165-D170 IonicContact NZ-OD1 2.76Å; K165-D170 PolarHBondContact NZ-OD1 2.91Å; K165-Y173 HydrophobicContact CB-CD1 4.21Å; K165-Y173 HydrophobicContact CB-CE1 4.17Å; K165-Y173 HydrophobicContact CD-CE1 4.42Å
166	P	93.4	Very high	91.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.267	C	S	.	.			trans	-69.8	130.6	175.1	29.8	-30.3	0	0	0	109.4	C168 C169 N172 M174 F202	P166-C168 PolarHBondContact O-N 3.47Å; P166-C169 WeakPolarHBondContact CG-SG 3.33Å; P166-C169 PolarHBondContact O-N 2.88Å; P166-C169 VanDerWaalsContact O-O 3.09Å; P166-N172 WeakPolarHBondContact CD-O 3.36Å; P166-N172 HydrophobicContact CG-CB 4.37Å; P166-M174 HydrophobicContact CB-CE 3.99Å; P166-M174 HydrophobicContact CG-CE 3.69Å; P166-F202 HydrophobicContact CB-CD2 3.73Å; P166-F202 HydrophobicContact CB-CE2 3.86Å
167	P	93	Very high	92.1	Very high	71 Å²	71	55.4 Å²	55.4	46%	0.461	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-18.9	179	29.1	-37.6	0	0	0	113.3	C169 V201 A205	P167-C169 VanDerWaalsContact C-N 3.35Å; P167-V201 HydrophobicContact CB-CG1 4.36Å; P167-V201 HydrophobicContact CG-CG1 3.84Å; P167-A205 HydrophobicContact CG-CB 3.5Å; P167-A205 VanDerWaalsContact CG-CB 3.5Å
168	C	93.6	Very high	92.5	Very high	35 Å²	35	50.9 Å²	50.9	24%	0.236	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-11.6	178.8	55.3	0	0	0	0	114	P166 C193 C196 N198 V201	P166-C168 PolarHBondContact O-N 3.47Å; C168-C193 VanDerWaalsContact SG-CB 3.57Å; C168-C193 VanDerWaalsContact SG-SG 3.6Å; C168-C196 PolarHBondContact SG-SG 3.46Å; C168-N198 HydrophobicContact CB-CB 3.92Å; C168-V201 HydrophobicContact CB-CB 4.27Å; C168-V201 HydrophobicContact CB-CG1 4.36Å
169	C	90.6	Very high	92.9	Very high	19 Å²	19	42.9 Å²	42.9	13%	0.128	21%	0.213	C	C	.	.	S	Bend	trans	-150.9	125	174.7	63	0	0	0	0	113.3	P166 P167 K171	P166-C169 WeakPolarHBondContact CG-SG 3.33Å; P166-C169 PolarHBondContact O-N 2.88Å; P166-C169 VanDerWaalsContact O-O 3.09Å; P167-C169 VanDerWaalsContact C-N 3.35Å; C169-K171 VanDerWaalsContact C-N 3.35Å; C169-K171 PolarHBondContact O-N 3.22Å; C169-K171 VanDerWaalsContact O-N 3.15Å
170	D	78.4	Confident	93.1	Very high	121 Å²	121	40.7 Å²	40.7	65%	0.647	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.9	8.5	-157.6	-94.7	-42.4	0	0	0	117.7	K165	K165-D170 VanDerWaalsContact CE-CA 3.46Å; K165-D170 WeakPolarHBondContact CE-O 3.09Å; K165-D170 WeakPolarHBondContact CE-OD1 3.49Å; K165-D170 PolarHBondContact NZ-O 2.75Å; K165-D170 IonicContact NZ-OD1 2.76Å; K165-D170 PolarHBondContact NZ-OD1 2.91Å
171	K	84.7	Confident	93.2	Very high	184 Å²	184	42.9 Å²	42.9	80%	0.8	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-129.4	3.3	-169.4	-61.3	-176.5	-178.8	179.3	0	114.9	C169	C169-K171 VanDerWaalsContact C-N 3.35Å; C169-K171 PolarHBondContact O-N 3.22Å; C169-K171 VanDerWaalsContact O-N 3.15Å
172	N	92.5	Very high	93.2	Very high	23 Å²	23	43.5 Å²	43.5	12%	0.123	21%	0.211	C	C	.	.			trans	-117.6	143.2	-169.7	-60.5	-78.1	0	0	0	110.9	T149 P166 V195	T149-N172 HydrophobicContact CG2-CB 3.75Å; T149-N172 WeakPolarHBondContact CG2-OD1 3.22Å; P166-N172 WeakPolarHBondContact CD-O 3.36Å; P166-N172 HydrophobicContact CG-CB 4.37Å; N172-V195 HydrophobicContact CB-CG2 3.87Å; N172-V195 WeakPolarHBondContact ND2-CG1 3.34Å
173	Y	95.4	Very high	93.2	Very high	28 Å²	28	41.4 Å²	41.4	11%	0.11	20%	0.199	C	C	.	.			trans	-130.8	147.2	177.9	-67.2	-94.9	0	0	0	109.3	S140 P142 T146 C148 T149 L155 Y163 M164 K165	S140-Y173 PolarHBondContact OG-OH 3.25Å; P142-Y173 HydrophobicContact CB-CD1 3.95Å; P142-Y173 HydrophobicContact CB-CD2 3.97Å; P142-Y173 HydrophobicContact CB-CE1 3.95Å; P142-Y173 HydrophobicContact CB-CE2 3.97Å; P142-Y173 HydrophobicContact CB-CG 3.95Å; P142-Y173 HydrophobicContact CG-CD1 4.09Å; P142-Y173 HydrophobicContact CG-CE1 4.2Å; P142-Y173 HydrophobicContact CG-CG 4.46Å; T146-Y173 HydrophobicContact CG2-CD2 3.69Å; T146-Y173 HydrophobicContact CG2-CE2 4.42Å; T146-Y173 HydrophobicContact CG2-CG 4.25Å; C148-Y173 CarbonylContact C-O 3.52Å; C148-Y173 WeakPolarHBondContact CA-O 3.38Å; T149-Y173 PolarHBondContact N-O 2.91Å; L155-Y173 HydrophobicContact CD1-CG 4.06Å; Y163-Y173 HydrophobicContact CD2-CD1 4.04Å; Y163-Y173 HydrophobicContact CE2-CD1 4.37Å; Y163-Y173 HydrophobicContact CE2-CE1 4.43Å; M164-Y173 WeakPolarHBondContact O-CA 3.45Å; K165-Y173 HydrophobicContact CB-CD1 4.21Å; K165-Y173 HydrophobicContact CB-CE1 4.17Å; K165-Y173 HydrophobicContact CD-CE1 4.42Å
174	M	96.1	Very high	93.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	144.6	-178.7	-66.9	167.5	-82.9	0	0	109.4	T149 I150 Y163 M164 P166 R176 V179 P194 F202	T149-M174 WeakPolarHBondContact OG1-CG 3.38Å; I150-M174 HydrophobicContact CD1-CB 4.15Å; I150-M174 HydrophobicContact CD1-CG 3.9Å; I150-M174 HydrophobicContact CD1-SD 3.63Å; I150-M174 HydrophobicContact CG1-CG 3.96Å; I150-M174 HydrophobicContact CG1-SD 3.94Å; Y163-M174 CarbonylContact C-O 3.32Å; Y163-M174 VanDerWaalsContact CA-O 3.23Å; Y163-M174 WeakPolarHBondContact CA-O 3.47Å; Y163-M174 WeakPolarHBondContact CB-O 3.48Å; M164-M174 PolarHBondContact N-O 3.38Å; M164-M174 PolarHBondContact O-N 3.32Å; P166-M174 HydrophobicContact CB-CE 3.99Å; P166-M174 HydrophobicContact CG-CE 3.69Å; M174-R176 PolarHBondContact O-N 2.94Å; M174-V179 HydrophobicContact CB-CG2 3.56Å; M174-V179 HydrophobicContact CE-CG2 4.45Å; M174-V179 HydrophobicContact CG-CG2 4.29Å; M174-V179 HydrophobicContact SD-CG2 3.87Å; M174-P194 HydrophobicContact CE-CG 4.5Å; M174-P194 HydrophobicContact SD-CG 3.5Å; M174-P194 WeakPolarHBondContact SD-CG 2.99Å; M174-F202 HydrophobicContact CE-CE2 3.88Å; M174-F202 HydrophobicContact CE-CZ 4.36Å
175	H	96.4	Very high	92.9	Very high	14 Å²	14	44.8 Å²	44.8	7%	0.065	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	141.3	168.3	-59.5	106.6	0	0	0	109.3	C148 C151 E154 R177 C178 V179	C148-H175 VanDerWaalsContact CB-CE1 3.47Å; C148-H175 WeakPolarHBondContact CB-CE1 3.37Å; C148-H175 VanDerWaalsContact CB-ND1 3.29Å; C148-H175 WeakPolarHBondContact CB-ND1 3.1Å; C148-H175 PolarHBondContact SG-N 3.49Å; C148-H175 PolarHBondContact SG-ND1 3.34Å; C151-H175 VanDerWaalsContact SG-CE1 3.53Å; C151-H175 PolarHBondContact SG-ND1 3.12Å; E154-H175 PolarHBondContact O-CE1 3.2Å; E154-H175 PolarHBondContact O-NE2 3.4Å; H175-R177 HydrophobicContact CB-CG 3.7Å; H175-R177 PolarHBondContact O-N 3.37Å; H175-C178 HydrophobicContact CB-CB 4.13Å; H175-C178 WeakPolarHBondContact O-CB 3.21Å; H175-C178 PolarHBondContact O-N 3.09Å; H175-V179 PolarHBondContact O-N 3.43Å; H175-V179 VanDerWaalsContact O-N 3.1Å
176	R	95.3	Very high	92.7	Very high	32 Å²	32	43 Å²	43	12%	0.121	21%	0.208	C	C	.	.	H	α-helix	trans	-55	-42.4	174.2	-171.1	-179.5	178.8	92.4	3.7	111.7	F161 T162 M164 M174 C178 V179 Q180 A209 G210 I211	F161-R176 VanDerWaalsContact CZ-CZ 3.49Å; F161-R176 WeakPolarHBondContact O-CD 3.34Å; T162-R176 WeakPolarHBondContact O-CB 3.36Å; T162-R176 PolarHBondContact O-N 3.01Å; M164-R176 HydrophobicContact CE-CG 4.41Å; M164-R176 HydrophobicContact CG-CB 4.42Å; M164-R176 HydrophobicContact CG-CG 4.49Å; M164-R176 HydrophobicContact SD-CG 4.04Å; M174-R176 PolarHBondContact O-N 2.94Å; R176-C178 VanDerWaalsContact C-N 3.35Å; R176-C178 PolarHBondContact O-N 2.8Å; R176-V179 PolarHBondContact O-N 2.89Å; R176-Q180 WeakPolarHBondContact O-CB 3.35Å; R176-Q180 PolarHBondContact O-N 3.01Å; R176-A209 PolarHBondContact NH1-O 2.99Å; R176-A209 PolarHBondContact NH2-O 2.93Å; R176-G210 PolarHBondContact NH2-O 3.32Å; R176-I211 HydrophobicContact CG-CD1 3.9Å
177	R	94.3	Very high	92.6	Very high	130 Å²	130	43 Å²	43	49%	0.491	21%	0.208	S	C	.	.	H	α-helix	trans	-59.7	-39.4	174.2	59.1	170.6	-177.8	141.3	6.3	113.3	E153 H175 Q180 K181	E153-R177 IonicContact OE2-CZ 3.8Å; E153-R177 IonicContact OE2-NH2 2.7Å; E153-R177 PolarHBondContact OE2-NH2 3.43Å; H175-R177 HydrophobicContact CB-CG 3.7Å; H175-R177 PolarHBondContact O-N 3.37Å; R177-Q180 PolarHBondContact O-N 3.35Å; R177-K181 WeakPolarHBondContact O-CB 3.49Å; R177-K181 PolarHBondContact O-N 3.5Å
178	C	96.1	Very high	92.5	Very high	17 Å²	17	40.7 Å²	40.7	12%	0.115	20%	0.196	C	C	.	.	H	α-helix	trans	-69	-42.3	-179	-69.2	0	0	0	0	110.9	I150 C151 H175 R176 Q180 K181 M182	I150-C178 HydrophobicContact CB-CB 3.94Å; I150-C178 HydrophobicContact CD1-CB 3.82Å; I150-C178 HydrophobicContact CG1-CB 4.47Å; I150-C178 HydrophobicContact CG2-CB 4Å; C151-C178 VanDerWaalsContact SG-SG 3.69Å; H175-C178 HydrophobicContact CB-CB 4.13Å; H175-C178 WeakPolarHBondContact O-CB 3.21Å; H175-C178 PolarHBondContact O-N 3.09Å; R176-C178 VanDerWaalsContact C-N 3.35Å; R176-C178 PolarHBondContact O-N 2.8Å; C178-Q180 VanDerWaalsContact C-N 3.34Å; C178-K181 PolarHBondContact O-N 2.84Å; C178-M182 WeakPolarHBondContact O-CB 3.28Å; C178-M182 PolarHBondContact O-N 3.47Å
179	V	95.7	Very high	92.2	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.8	-39.5	175	180	0	0	0	0	111.1	I150 M164 M174 H175 R176 K181 M182 A183 F191 F202 M206 I211	I150-V179 HydrophobicContact CD1-CG2 3.97Å; M164-V179 HydrophobicContact CE-CB 3.29Å; M164-V179 HydrophobicContact CE-CG1 3.48Å; M164-V179 VanDerWaalsContact CE-CG1 3.48Å; M164-V179 HydrophobicContact CE-CG2 3.41Å; M164-V179 VanDerWaalsContact CE-CG2 3.41Å; M174-V179 HydrophobicContact CB-CG2 3.56Å; M174-V179 HydrophobicContact CE-CG2 4.45Å; M174-V179 HydrophobicContact CG-CG2 4.29Å; M174-V179 HydrophobicContact SD-CG2 3.87Å; H175-V179 PolarHBondContact O-N 3.43Å; H175-V179 VanDerWaalsContact O-N 3.1Å; R176-V179 PolarHBondContact O-N 2.89Å; V179-K181 PolarHBondContact O-N 2.81Å; V179-M182 HydrophobicContact CG1-CE 4.3Å; V179-M182 PolarHBondContact O-N 3.14Å; V179-A183 WeakPolarHBondContact O-CB 3.5Å; V179-A183 PolarHBondContact O-N 3.25Å; V179-F191 HydrophobicContact CG1-CE2 4.15Å; V179-F191 HydrophobicContact CG1-CZ 3.79Å; V179-F202 HydrophobicContact CG1-CZ 4.17Å; V179-M206 HydrophobicContact CG1-CG 4.04Å; V179-M206 HydrophobicContact CG1-SD 3.9Å; V179-I211 HydrophobicContact CB-CD1 4.43Å; V179-I211 HydrophobicContact CG1-CD1 4.32Å; V179-I211 HydrophobicContact CG1-CG1 4.13Å; V179-I211 HydrophobicContact CG1-CG2 4.35Å
180	Q	95.1	Very high	92.2	Very high	11 Å²	11	48 Å²	48	5%	0.051	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-43.6	175.5	-176.8	58.3	73.1	0	0	112.1	R176 R177 C178 A183 L184 I211 Y212	R176-Q180 WeakPolarHBondContact O-CB 3.35Å; R176-Q180 PolarHBondContact O-N 3.01Å; R177-Q180 PolarHBondContact O-N 3.35Å; C178-Q180 VanDerWaalsContact C-N 3.34Å; Q180-A183 PolarHBondContact O-N 2.95Å; Q180-L184 WeakPolarHBondContact O-CG 3.31Å; Q180-L184 PolarHBondContact O-N 3.04Å; Q180-L184 VanDerWaalsContact O-N 3.09Å; Q180-I211 HydrophobicContact CB-CD1 4.22Å; Q180-Y212 PolarHBondContact NE2-O 3.18Å
181	K	94.1	Very high	92.9	Very high	97 Å²	97	42.3 Å²	42.3	42%	0.422	19%	0.187	S	C	.	.	H	α-helix	trans	-65.8	-42.5	175.9	-176	173.7	175.8	175.7	0	111.9	R177 C178 V179 A183 L184 E185	R177-K181 WeakPolarHBondContact O-CB 3.49Å; R177-K181 PolarHBondContact O-N 3.5Å; C178-K181 PolarHBondContact O-N 2.84Å; V179-K181 PolarHBondContact O-N 2.81Å; K181-A183 VanDerWaalsContact C-N 3.34Å; K181-A183 PolarHBondContact O-N 3.2Å; K181-L184 CarbonylContact O-C 3.53Å; K181-L184 WeakPolarHBondContact O-CB 3.4Å; K181-L184 PolarHBondContact O-N 3.26Å; K181-E185 WeakPolarHBondContact CE-OE1 3.4Å; K181-E185 IonicContact NZ-OE1 3.95Å; K181-E185 PolarHBondContact O-N 3.47Å
182	M	94.5	Very high	93.3	Very high	26 Å²	26	34.5 Å²	34.5	13%	0.128	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-42.9	174.9	-177.3	-179.7	75.6	0	0	111.7	I150 C178 V179 L184 E185 S186 F191 P194 F202	I150-M182 HydrophobicContact CD1-CE 4.34Å; I150-M182 HydrophobicContact CD1-SD 3.94Å; C178-M182 WeakPolarHBondContact O-CB 3.28Å; C178-M182 PolarHBondContact O-N 3.47Å; V179-M182 HydrophobicContact CG1-CE 4.3Å; V179-M182 PolarHBondContact O-N 3.14Å; M182-L184 VanDerWaalsContact C-N 3.3Å; M182-L184 PolarHBondContact O-N 3.43Å; M182-E185 PolarHBondContact O-N 3.36Å; M182-S186 WeakPolarHBondContact O-CB 3.4Å; M182-S186 PolarHBondContact O-N 2.82Å; M182-S186 PolarHBondContact O-OG 3.5Å; M182-S186 VanDerWaalsContact O-OG 3.12Å; M182-F191 HydrophobicContact CE-CD2 4.04Å; M182-F191 HydrophobicContact CE-CE2 3.44Å; M182-F191 VanDerWaalsContact CE-CE2 3.44Å; M182-F191 HydrophobicContact CE-CZ 4.28Å; M182-F191 HydrophobicContact CG-CE2 4.5Å; M182-P194 HydrophobicContact CE-CG 4.38Å; M182-P194 HydrophobicContact SD-CB 4.18Å; M182-P194 HydrophobicContact SD-CG 4.11Å; M182-F202 HydrophobicContact CE-CE1 3.65Å; M182-F202 HydrophobicContact CE-CZ 3.69Å
183	A	94.7	Very high	93.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.2	-41.2	175.3	0	0	0	0	0	112.2	V179 Q180 K181 G187 F191 I211 Y212 V213	V179-A183 WeakPolarHBondContact O-CB 3.5Å; V179-A183 PolarHBondContact O-N 3.25Å; Q180-A183 PolarHBondContact O-N 2.95Å; K181-A183 VanDerWaalsContact C-N 3.34Å; K181-A183 PolarHBondContact O-N 3.2Å; A183-G187 WeakPolarHBondContact O-CA 3.41Å; A183-G187 PolarHBondContact O-N 3.47Å; A183-F191 VanDerWaalsContact CA-CD2 3.48Å; A183-F191 HydrophobicContact CB-CD2 3.85Å; A183-F191 HydrophobicContact CB-CE2 3.5Å; A183-F191 HydrophobicContact CB-CG 4.47Å; A183-F191 HydrophobicContact CB-CZ 3.87Å; A183-I211 HydrophobicContact CB-CG2 3.73Å; A183-Y212 WeakPolarHBondContact CB-O 3.37Å; A183-V213 HydrophobicContact CB-CG2 4.02Å
184	L	92.2	Very high	93.4	Very high	12 Å²	12	34.1 Å²	34.1	6%	0.063	16%	0.158	C	C	.	.	H	α-helix	trans	-65.5	-46.6	172.9	-67.1	169.2	0	0	0	110.4	E30 E31 Q180 K181 M182 S186 Y212 P214 R216	E30-L184 HydrophobicContact CB-CD1 4.44Å; E30-L184 HydrophobicContact CB-CD2 4.03Å; E31-L184 HydrophobicContact CB-CD1 3.7Å; E31-L184 HydrophobicContact CG-CD1 4.21Å; Q180-L184 WeakPolarHBondContact O-CG 3.31Å; Q180-L184 PolarHBondContact O-N 3.04Å; Q180-L184 VanDerWaalsContact O-N 3.09Å; K181-L184 CarbonylContact O-C 3.53Å; K181-L184 WeakPolarHBondContact O-CB 3.4Å; K181-L184 PolarHBondContact O-N 3.26Å; M182-L184 VanDerWaalsContact C-N 3.3Å; M182-L184 PolarHBondContact O-N 3.43Å; L184-S186 PolarHBondContact O-N 2.77Å; L184-Y212 HydrophobicContact CD2-CD1 3.85Å; L184-Y212 HydrophobicContact CD2-CE1 4.04Å; L184-P214 HydrophobicContact CD2-CG 4.1Å; L184-R216 PolarHBondContact O-NH1 2.93Å; L184-R216 PolarHBondContact O-NH2 3.07Å
185	E	90.6	Very high	93.2	Very high	69 Å²	69	35.5 Å²	35.5	32%	0.322	17%	0.167	S	C	.	.	H	α-helix	trans	-67	-39.5	-178.1	-70.6	173	177.9	0	0	112.5	K181 M182 C218 S219	K181-E185 WeakPolarHBondContact CE-OE1 3.4Å; K181-E185 IonicContact NZ-OE1 3.95Å; K181-E185 PolarHBondContact O-N 3.47Å; M182-E185 PolarHBondContact O-N 3.36Å; E185-C218 CarbonylContact O-C 3.54Å; E185-C218 VanDerWaalsContact O-CA 3.32Å; E185-C218 WeakPolarHBondContact O-CA 3.46Å; E185-S219 PolarHBondContact O-N 3.47Å
186	S	90.7	Very high	93.1	Very high	13 Å²	13	37.6 Å²	37.6	9%	0.091	18%	0.183	C	C	.	.	H	α-helix	trans	-83.6	-26.6	-176.4	-54.2	0	0	0	0	114.8	M182 L184 C218	M182-S186 WeakPolarHBondContact O-CB 3.4Å; M182-S186 PolarHBondContact O-N 2.82Å; M182-S186 PolarHBondContact O-OG 3.5Å; M182-S186 VanDerWaalsContact O-OG 3.12Å; L184-S186 PolarHBondContact O-N 2.77Å; S186-C218 PolarHBondContact O-SG 3.02Å
187	G	90.7	Very high	93	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	60	174.6	-168.7	0	0	0	0	0	113.2	A183 Y189 Y190 F191 P214 R216	A183-G187 WeakPolarHBondContact O-CA 3.41Å; A183-G187 PolarHBondContact O-N 3.47Å; G187-Y189 VanDerWaalsContact C-N 3.26Å; G187-Y189 PolarHBondContact O-N 3.36Å; G187-Y190 PolarHBondContact O-N 3.4Å; G187-F191 WeakPolarHBondContact O-CB 3.07Å; G187-F191 PolarHBondContact O-N 3.42Å; G187-F191 VanDerWaalsContact O-N 3.11Å; G187-P214 WeakPolarHBondContact CA-O 3.19Å; G187-R216 WeakPolarHBondContact CA-O 3.48Å
188	A	90.4	Very high	92.9	Very high	24 Å²	24	42.8 Å²	42.8	20%	0.198	21%	0.207	C	C	.	.	H	α-helix	trans	-59.6	-33.8	-174	0	0	0	0	0	113.8	Y190 V213 P214	A188-Y190 VanDerWaalsContact C-N 3.35Å; A188-Y190 PolarHBondContact O-N 2.89Å; A188-V213 HydrophobicContact CB-CG1 4.05Å; A188-P214 PolarHBondContact N-O 3.13Å
189	Y	87.3	Confident	92.6	Very high	125 Å²	125	43.7 Å²	43.7	49%	0.49	21%	0.213	S	C	.	.	H	α-helix	trans	-70.5	-26.9	-174.2	-59.5	-73.6	0	0	0	114.1	G187 T215 R216	G187-Y189 VanDerWaalsContact C-N 3.26Å; G187-Y189 PolarHBondContact O-N 3.36Å; Y189-T215 HydrophobicContact CE2-CG2 4.33Å; Y189-R216 VanDerWaalsContact CD2-O 3.28Å; Y189-R216 WeakPolarHBondContact CD2-O 3.22Å
190	Y	90.4	Very high	92.4	Very high	82 Å²	82	48.8 Å²	48.8	32%	0.322	24%	0.235	S	C	.	.	H	α-helix	trans	-123.7	4.6	-175.3	-59.5	-99.3	0	0	0	113.3	G187 A188 A192 D217 C218 P385	G187-Y190 PolarHBondContact O-N 3.4Å; A188-Y190 VanDerWaalsContact C-N 3.35Å; A188-Y190 PolarHBondContact O-N 2.89Å; Y190-A192 PolarHBondContact O-N 3.46Å; Y190-D217 WeakPolarHBondContact CE2-OD1 3.44Å; Y190-C218 WeakPolarHBondContact CB-SG 3.48Å; Y190-C218 HydrophobicContact CD2-CB 4.46Å; Y190-C218 WeakPolarHBondContact CD2-SG 3.39Å; Y190-P385 HydrophobicContact CE1-CG 4.01Å
191	F	93.9	Very high	92.4	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.009	25%	0.253	C	S	.	.			trans	-71.8	103.6	179	-176	-119.4	0	0	0	111.4	V179 M182 A183 G187 F202 H203 M206 I211 V213	V179-F191 HydrophobicContact CG1-CE2 4.15Å; V179-F191 HydrophobicContact CG1-CZ 3.79Å; M182-F191 HydrophobicContact CE-CD2 4.04Å; M182-F191 HydrophobicContact CE-CE2 3.44Å; M182-F191 VanDerWaalsContact CE-CE2 3.44Å; M182-F191 HydrophobicContact CE-CZ 4.28Å; M182-F191 HydrophobicContact CG-CE2 4.5Å; A183-F191 VanDerWaalsContact CA-CD2 3.48Å; A183-F191 HydrophobicContact CB-CD2 3.85Å; A183-F191 HydrophobicContact CB-CE2 3.5Å; A183-F191 HydrophobicContact CB-CG 4.47Å; A183-F191 HydrophobicContact CB-CZ 3.87Å; G187-F191 WeakPolarHBondContact O-CB 3.07Å; G187-F191 PolarHBondContact O-N 3.42Å; G187-F191 VanDerWaalsContact O-N 3.11Å; F191-F202 HydrophobicContact CD1-CD1 4.43Å; F191-F202 HydrophobicContact CD1-CE1 4.38Å; F191-F202 HydrophobicContact CD2-CE1 4.32Å; F191-F202 HydrophobicContact CE1-CD1 4.08Å; F191-F202 AromaticContact CE1-CE1 3.8Å; F191-F202 HydrophobicContact CE1-CE1 3.8Å; F191-F202 AromaticContact CE2-CE1 3.74Å; F191-F202 HydrophobicContact CE2-CE1 3.74Å; F191-F202 HydrophobicContact CE2-CZ 4.5Å; F191-F202 HydrophobicContact CZ-CD1 4.2Å; F191-F202 AromaticContact CZ-CE1 3.45Å; F191-F202 HydrophobicContact CZ-CE1 3.45Å; F191-F202 VanDerWaalsContact CZ-CE1 3.45Å; F191-F202 HydrophobicContact CZ-CZ 4.16Å; F191-H203 HydrophobicContact CD1-CB 4.31Å; F191-H203 AromaticContact CD1-CD2 3.66Å; F191-M206 HydrophobicContact CE1-CB 3.73Å; F191-M206 HydrophobicContact CE1-CG 4.03Å; F191-M206 HydrophobicContact CZ-CB 3.91Å; F191-M206 HydrophobicContact CZ-CG 3.93Å; F191-I211 HydrophobicContact CZ-CG2 4.35Å; F191-V213 HydrophobicContact CB-CG1 4.14Å; F191-V213 HydrophobicContact CD1-CG1 4.13Å; F191-V213 HydrophobicContact CD1-CG2 3.78Å; F191-V213 HydrophobicContact CE1-CG2 3.72Å; F191-V213 HydrophobicContact CG-CG1 4.24Å; F191-V213 HydrophobicContact CG-CG2 4.48Å; F191-V213 HydrophobicContact CZ-CG2 4.38Å
192	A	94.1	Very high	92.5	Very high	20 Å²	20	47 Å²	47	17%	0.165	23%	0.233	C	C	.	.			trans	-134.8	163.9	-177.5	0	0	0	0	0	111.8	Y190 P194 R197 C199 F202	Y190-A192 PolarHBondContact O-N 3.46Å; A192-P194 WeakPolarHBondContact O-CD 3.36Å; A192-R197 HydrophobicContact CB-CG 4.42Å; A192-C199 HydrophobicContact CB-CB 3.98Å; A192-F202 WeakPolarHBondContact O-CE1 3.5Å
193	C	96	Very high	92.4	Very high	4 Å²	4	47.7 Å²	47.7	3%	0.027	24%	0.236	C	C	.	.			trans	-59.9	124.8	174.7	178.6	0	0	0	0	110.1	C168 V195 C196 R197 N198 F202	C168-C193 VanDerWaalsContact SG-CB 3.57Å; C168-C193 VanDerWaalsContact SG-SG 3.6Å; C193-V195 PolarHBondContact O-N 3.37Å; C193-V195 PolarHBondContact SG-N 2.99Å; C193-C196 VanDerWaalsContact SG-SG 3.62Å; C193-R197 WeakPolarHBondContact O-CA 3.47Å; C193-R197 PolarHBondContact O-N 3.48Å; C193-N198 WeakPolarHBondContact CB-O 3.36Å; C193-N198 PolarHBondContact N-O 2.78Å; C193-N198 VanDerWaalsContact N-O 3.14Å; C193-F202 HydrophobicContact CB-CB 3.88Å; C193-F202 HydrophobicContact CB-CD1 4.31Å; C193-F202 HydrophobicContact CB-CD2 3.77Å; C193-F202 HydrophobicContact CB-CE2 4.39Å; C193-F202 HydrophobicContact CB-CG 3.72Å; C193-F202 VanDerWaalsContact N-CD1 3.27Å
194	P	93.2	Very high	92.4	Very high	38 Å²	38	54 Å²	54	25%	0.247	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-8.6	-178.1	27.1	-34.3	0	0	0	113.2	I150 M174 M182 A192	I150-P194 HydrophobicContact CG1-CG 4.21Å; M174-P194 HydrophobicContact CE-CG 4.5Å; M174-P194 HydrophobicContact SD-CG 3.5Å; M174-P194 WeakPolarHBondContact SD-CG 2.99Å; M182-P194 HydrophobicContact CE-CG 4.38Å; M182-P194 HydrophobicContact SD-CB 4.18Å; M182-P194 HydrophobicContact SD-CG 4.11Å; A192-P194 WeakPolarHBondContact O-CD 3.36Å
195	V	92.9	Very high	92.5	Very high	30 Å²	30	54.6 Å²	54.6	18%	0.182	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-54.3	-177.8	-178.8	0	0	0	0	112	N172 C193	N172-V195 HydrophobicContact CB-CG2 3.87Å; N172-V195 WeakPolarHBondContact ND2-CG1 3.34Å; C193-V195 PolarHBondContact O-N 3.37Å; C193-V195 PolarHBondContact SG-N 2.99Å
196	C	94.1	Very high	92.7	Very high	58 Å²	58	51.5 Å²	51.5	39%	0.392	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	0.7	-173.6	65.5	0	0	0	0	113.5	C168 C193 N198	C168-C196 PolarHBondContact SG-SG 3.46Å; C193-C196 VanDerWaalsContact SG-SG 3.62Å; C196-N198 PolarHBondContact O-N 3.32Å
197	R	92.1	Very high	92.9	Very high	211 Å²	211	52.4 Å²	52.4	80%	0.796	26%	0.26	S	S	*	.			trans	59.2	8.1	-178.7	-154.6	171.3	-179.3	-164.7	-1.6	115.4	A192 C193 C199	A192-R197 HydrophobicContact CB-CG 4.42Å; C193-R197 WeakPolarHBondContact O-CA 3.47Å; C193-R197 PolarHBondContact O-N 3.48Å; R197-C199 PolarHBondContact O-N 3.1Å
198	N	92.2	Very high	93.1	Very high	60 Å²	60	56.6 Å²	56.6	32%	0.321	28%	0.28	S	S	.	.			trans	-62.8	113.6	170.9	-173.7	-60.1	0	0	0	109	C168 C193 C196 K200 V201 F202	C168-N198 HydrophobicContact CB-CB 3.92Å; C193-N198 WeakPolarHBondContact CB-O 3.36Å; C193-N198 PolarHBondContact N-O 2.78Å; C193-N198 VanDerWaalsContact N-O 3.14Å; C196-N198 PolarHBondContact O-N 3.32Å; N198-K200 PolarHBondContact OD1-N 2.85Å; N198-V201 VanDerWaalsContact OD1-CB 3.27Å; N198-V201 WeakPolarHBondContact OD1-CB 3.04Å; N198-V201 WeakPolarHBondContact OD1-CG2 3.28Å; N198-V201 PolarHBondContact OD1-N 3.28Å; N198-F202 WeakPolarHBondContact O-CB 3.42Å
199	C	90.4	Very high	93.3	Very high	36 Å²	36	56.1 Å²	56.1	24%	0.243	28%	0.275	C	S	.	.			trans	-87.1	-48.9	178.4	56.8	0	0	0	0	111.4	A192 R197 V201 F202 H203 C381	A192-C199 HydrophobicContact CB-CB 3.98Å; R197-C199 PolarHBondContact O-N 3.1Å; C199-V201 PolarHBondContact O-N 3.22Å; C199-F202 PolarHBondContact O-N 3.32Å; C199-H203 WeakPolarHBondContact O-CB 3.27Å; C199-H203 PolarHBondContact O-N 2.61Å; C199-C381 VanDerWaalsContact SG-CB 3.57Å
200	K	91.7	Very high	93.7	Very high	107 Å²	107	50.3 Å²	50.3	47%	0.465	25%	0.253	S	S	.	.	H	α-helix	trans	-56.3	-53.1	-172.4	-64.1	-176.7	-178.4	177.2	0	112.8	N198 K204 D380	N198-K200 PolarHBondContact OD1-N 2.85Å; K200-K204 PolarHBondContact O-N 2.96Å; K200-D380 IonicContact NZ-OD1 2.75Å; K200-D380 PolarHBondContact NZ-OD1 2.86Å
201	V	94.8	Very high	93.9	Very high	70 Å²	70	46.4 Å²	46.4	42%	0.424	24%	0.238	S	C	.	.	H	α-helix	trans	-73.9	-40.8	-177.1	-172.3	0	0	0	0	110.7	P167 C168 N198 C199 A205	P167-V201 HydrophobicContact CB-CG1 4.36Å; P167-V201 HydrophobicContact CG-CG1 3.84Å; C168-V201 HydrophobicContact CB-CB 4.27Å; C168-V201 HydrophobicContact CB-CG1 4.36Å; N198-V201 VanDerWaalsContact OD1-CB 3.27Å; N198-V201 WeakPolarHBondContact OD1-CB 3.04Å; N198-V201 WeakPolarHBondContact OD1-CG2 3.28Å; N198-V201 PolarHBondContact OD1-N 3.28Å; C199-V201 PolarHBondContact O-N 3.22Å; V201-A205 WeakPolarHBondContact O-CB 3.49Å; V201-A205 PolarHBondContact O-N 3.34Å
202	F	94.8	Very high	94	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67	-50.9	-178.7	-177.5	-104.3	0	0	0	112	P166 M174 V179 M182 F191 A192 C193 N198 C199 K204 A205 M206	P166-F202 HydrophobicContact CB-CD2 3.73Å; P166-F202 HydrophobicContact CB-CE2 3.86Å; M174-F202 HydrophobicContact CE-CE2 3.88Å; M174-F202 HydrophobicContact CE-CZ 4.36Å; V179-F202 HydrophobicContact CG1-CZ 4.17Å; M182-F202 HydrophobicContact CE-CE1 3.65Å; M182-F202 HydrophobicContact CE-CZ 3.69Å; F191-F202 HydrophobicContact CD1-CD1 4.43Å; F191-F202 HydrophobicContact CD1-CE1 4.38Å; F191-F202 HydrophobicContact CD2-CE1 4.32Å; F191-F202 HydrophobicContact CE1-CD1 4.08Å; F191-F202 AromaticContact CE1-CE1 3.8Å; F191-F202 HydrophobicContact CE1-CE1 3.8Å; F191-F202 AromaticContact CE2-CE1 3.74Å; F191-F202 HydrophobicContact CE2-CE1 3.74Å; F191-F202 HydrophobicContact CE2-CZ 4.5Å; F191-F202 HydrophobicContact CZ-CD1 4.2Å; F191-F202 AromaticContact CZ-CE1 3.45Å; F191-F202 HydrophobicContact CZ-CE1 3.45Å; F191-F202 VanDerWaalsContact CZ-CE1 3.45Å; F191-F202 HydrophobicContact CZ-CZ 4.16Å; A192-F202 WeakPolarHBondContact O-CE1 3.5Å; C193-F202 HydrophobicContact CB-CB 3.88Å; C193-F202 HydrophobicContact CB-CD1 4.31Å; C193-F202 HydrophobicContact CB-CD2 3.77Å; C193-F202 HydrophobicContact CB-CE2 4.39Å; C193-F202 HydrophobicContact CB-CG 3.72Å; C193-F202 VanDerWaalsContact N-CD1 3.27Å; N198-F202 WeakPolarHBondContact O-CB 3.42Å; C199-F202 PolarHBondContact O-N 3.32Å; F202-K204 PolarHBondContact O-N 3.22Å; F202-A205 PolarHBondContact O-N 3.33Å; F202-M206 HydrophobicContact CD1-CG 4.06Å; F202-M206 HydrophobicContact CD2-CE 4.15Å; F202-M206 HydrophobicContact CD2-CG 3.98Å; F202-M206 HydrophobicContact CD2-SD 4.39Å; F202-M206 HydrophobicContact CE1-CG 3.74Å; F202-M206 HydrophobicContact CE2-CE 3.95Å; F202-M206 HydrophobicContact CE2-CG 3.62Å; F202-M206 HydrophobicContact CE2-SD 3.73Å; F202-M206 HydrophobicContact CG-CG 4.19Å; F202-M206 HydrophobicContact CZ-CG 3.51Å; F202-M206 HydrophobicContact CZ-SD 3.94Å; F202-M206 WeakPolarHBondContact O-CB 3.26Å; F202-M206 VanDerWaalsContact O-CG 3.26Å; F202-M206 WeakPolarHBondContact O-CG 3.43Å; F202-M206 PolarHBondContact O-N 3.27Å
203	H	93.8	Very high	93.9	Very high	41 Å²	41	48.2 Å²	48.2	19%	0.19	24%	0.243	C	C	.	.	H	α-helix	trans	-55.3	-53.1	-178.9	-176.1	-71	0	0	0	110.6	F191 C199 A205 M206 V207	F191-H203 HydrophobicContact CD1-CB 4.31Å; F191-H203 AromaticContact CD1-CD2 3.66Å; C199-H203 WeakPolarHBondContact O-CB 3.27Å; C199-H203 PolarHBondContact O-N 2.61Å; H203-A205 PolarHBondContact O-N 3.2Å; H203-M206 PolarHBondContact O-N 2.96Å; H203-V207 WeakPolarHBondContact O-CG2 2.96Å; H203-V207 PolarHBondContact O-N 2.93Å
204	K	94.2	Very high	93.7	Very high	132 Å²	132	48.4 Å²	48.4	57%	0.574	24%	0.244	S	C	*	.	H	α-helix	trans	-54.4	-51.5	178	-179	175.9	177.1	176.5	0	111.8	K200 F202 M206 V207 E208	K200-K204 PolarHBondContact O-N 2.96Å; F202-K204 PolarHBondContact O-N 3.22Å; K204-M206 PolarHBondContact O-N 2.92Å; K204-V207 PolarHBondContact O-N 3.47Å; K204-E208 WeakPolarHBondContact CE-OE1 3.48Å; K204-E208 WeakPolarHBondContact CG-OE1 3.24Å; K204-E208 WeakPolarHBondContact O-CB 3.32Å; K204-E208 WeakPolarHBondContact O-CG 3.32Å; K204-E208 PolarHBondContact O-N 3.04Å
205	A	94.5	Very high	93.4	Very high	24 Å²	24	49.4 Å²	49.4	20%	0.198	25%	0.25	C	C	.	.	H	α-helix	trans	-65.5	-38	-176.6	0	0	0	0	0	113.3	P167 V201 F202 H203 A209	P167-A205 HydrophobicContact CG-CB 3.5Å; P167-A205 VanDerWaalsContact CG-CB 3.5Å; V201-A205 WeakPolarHBondContact O-CB 3.49Å; V201-A205 PolarHBondContact O-N 3.34Å; F202-A205 PolarHBondContact O-N 3.33Å; H203-A205 PolarHBondContact O-N 3.2Å; A205-A209 WeakPolarHBondContact O-CB 3.35Å; A205-A209 PolarHBondContact O-N 3.21Å
206	M	95.4	Very high	92.9	Very high	5 Å²	5	51 Å²	51	3%	0.025	25%	0.252	C	S	.	.	H	α-helix	trans	-69.6	-40.4	178.4	-66	-51.9	103	0	0	111.3	M164 V179 F191 F202 H203 K204 A209 G210 I211	M164-M206 HydrophobicContact CE-SD 3.5Å; M164-M206 VanDerWaalsContact CE-SD 3.5Å; M164-M206 HydrophobicContact SD-SD 4.08Å; V179-M206 HydrophobicContact CG1-CG 4.04Å; V179-M206 HydrophobicContact CG1-SD 3.9Å; F191-M206 HydrophobicContact CE1-CB 3.73Å; F191-M206 HydrophobicContact CE1-CG 4.03Å; F191-M206 HydrophobicContact CZ-CB 3.91Å; F191-M206 HydrophobicContact CZ-CG 3.93Å; F202-M206 HydrophobicContact CD1-CG 4.06Å; F202-M206 HydrophobicContact CD2-CE 4.15Å; F202-M206 HydrophobicContact CD2-CG 3.98Å; F202-M206 HydrophobicContact CD2-SD 4.39Å; F202-M206 HydrophobicContact CE1-CG 3.74Å; F202-M206 HydrophobicContact CE2-CE 3.95Å; F202-M206 HydrophobicContact CE2-CG 3.62Å; F202-M206 HydrophobicContact CE2-SD 3.73Å; F202-M206 HydrophobicContact CG-CG 4.19Å; F202-M206 HydrophobicContact CZ-CG 3.51Å; F202-M206 HydrophobicContact CZ-SD 3.94Å; F202-M206 WeakPolarHBondContact O-CB 3.26Å; F202-M206 VanDerWaalsContact O-CG 3.26Å; F202-M206 WeakPolarHBondContact O-CG 3.43Å; F202-M206 PolarHBondContact O-N 3.27Å; H203-M206 PolarHBondContact O-N 2.96Å; K204-M206 PolarHBondContact O-N 2.92Å; M206-A209 PolarHBondContact O-N 2.85Å; M206-G210 PolarHBondContact O-N 3.48Å; M206-I211 HydrophobicContact CB-CB 4.14Å; M206-I211 HydrophobicContact CB-CG1 4.09Å; M206-I211 VanDerWaalsContact O-CB 3.22Å; M206-I211 WeakPolarHBondContact O-CB 3.4Å; M206-I211 WeakPolarHBondContact O-CG1 3.47Å; M206-I211 PolarHBondContact O-N 3.09Å
207	V	94.7	Very high	92.5	Very high	31 Å²	31	50.8 Å²	50.8	19%	0.188	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-48.3	174.5	171.1	0	0	0	0	110.9	F121 H203 K204 A209 G210 V213	F121-V207 HydrophobicContact CD1-CG1 3.71Å; F121-V207 HydrophobicContact CE1-CG1 4.22Å; F121-V207 HydrophobicContact CG-CG1 4.48Å; H203-V207 WeakPolarHBondContact O-CG2 2.96Å; H203-V207 PolarHBondContact O-N 2.93Å; K204-V207 PolarHBondContact O-N 3.47Å; V207-A209 VanDerWaalsContact C-N 3.25Å; V207-A209 PolarHBondContact O-N 3.19Å; V207-G210 WeakPolarHBondContact O-CA 3.24Å; V207-G210 PolarHBondContact O-N 2.71Å; V207-V213 HydrophobicContact CG2-CB 4.42Å; V207-V213 HydrophobicContact CG2-CG2 3.77Å
208	E	94.2	Very high	92	Very high	89 Å²	89	40.8 Å²	40.8	42%	0.416	21%	0.21	S	C	.	.	H	α-helix	trans	-61.9	-32.8	176.5	-73.8	176.3	-178.4	0	0	112.7	K204 G210	K204-E208 WeakPolarHBondContact CE-OE1 3.48Å; K204-E208 WeakPolarHBondContact CG-OE1 3.24Å; K204-E208 WeakPolarHBondContact O-CB 3.32Å; K204-E208 WeakPolarHBondContact O-CG 3.32Å; K204-E208 PolarHBondContact O-N 3.04Å; E208-G210 PolarHBondContact O-N 3.02Å
209	A	94.8	Very high	91.6	Very high	13 Å²	13	39.1 Å²	39.1	11%	0.107	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-7.6	173.5	0	0	0	0	0	113.1	M164 R176 A205 M206 V207	M164-A209 HydrophobicContact SD-CB 4.2Å; R176-A209 PolarHBondContact NH1-O 2.99Å; R176-A209 PolarHBondContact NH2-O 2.93Å; A205-A209 WeakPolarHBondContact O-CB 3.35Å; A205-A209 PolarHBondContact O-N 3.21Å; M206-A209 PolarHBondContact O-N 2.85Å; V207-A209 VanDerWaalsContact C-N 3.25Å; V207-A209 PolarHBondContact O-N 3.19Å
210	G	95	Very high	90.9	Very high	3 Å²	3	42 Å²	42	3%	0.031	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.1	30.7	178	0	0	0	0	0	114.5	F118 R176 M206 V207 E208	F118-G210 VanDerWaalsContact O-CA 3.24Å; F118-G210 WeakPolarHBondContact O-CA 3.42Å; R176-G210 PolarHBondContact NH2-O 3.32Å; M206-G210 PolarHBondContact O-N 3.48Å; V207-G210 WeakPolarHBondContact O-CA 3.24Å; V207-G210 PolarHBondContact O-N 2.71Å; E208-G210 PolarHBondContact O-N 3.02Å
211	I	95.5	Very high	90	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.205	C	C	.	.			trans	-86.3	128.5	167.2	-60.7	-62.5	0	0	0	108.9	M164 R176 V179 Q180 A183 F191 M206 V213	M164-I211 HydrophobicContact CE-CD1 3.65Å; M164-I211 HydrophobicContact CE-CG1 3.75Å; M164-I211 HydrophobicContact SD-CD1 3.95Å; M164-I211 HydrophobicContact SD-CG1 3.96Å; R176-I211 HydrophobicContact CG-CD1 3.9Å; V179-I211 HydrophobicContact CB-CD1 4.43Å; V179-I211 HydrophobicContact CG1-CD1 4.32Å; V179-I211 HydrophobicContact CG1-CG1 4.13Å; V179-I211 HydrophobicContact CG1-CG2 4.35Å; Q180-I211 HydrophobicContact CB-CD1 4.22Å; A183-I211 HydrophobicContact CB-CG2 3.73Å; F191-I211 HydrophobicContact CZ-CG2 4.35Å; M206-I211 HydrophobicContact CB-CB 4.14Å; M206-I211 HydrophobicContact CB-CG1 4.09Å; M206-I211 VanDerWaalsContact O-CB 3.22Å; M206-I211 WeakPolarHBondContact O-CB 3.4Å; M206-I211 WeakPolarHBondContact O-CG1 3.47Å; M206-I211 PolarHBondContact O-N 3.09Å; I211-V213 HydrophobicContact CG2-CG2 4.25Å
212	Y	95	Very high	88.9	Confident	41 Å²	41	41.7 Å²	41.7	16%	0.161	21%	0.213	C	C	.	.			trans	-78	125.1	172	176	-114.3	0	0	0	110.1	F49 F120 Q180 A183 L184 P214	F49-Y212 HydrophobicContact CE1-CD1 4.32Å; F49-Y212 HydrophobicContact CE1-CD2 4.1Å; F49-Y212 HydrophobicContact CE1-CE1 4.11Å; F49-Y212 AromaticContact CE1-CE2 3.87Å; F49-Y212 HydrophobicContact CE1-CE2 3.87Å; F49-Y212 HydrophobicContact CE1-CG 4.3Å; F49-Y212 AromaticContact CE1-CZ 3.86Å; F49-Y212 HydrophobicContact CE2-CD1 4.41Å; F49-Y212 AromaticContact CZ-CD1 3.55Å; F49-Y212 HydrophobicContact CZ-CD1 3.55Å; F49-Y212 HydrophobicContact CZ-CD2 4.09Å; F49-Y212 AromaticContact CZ-CE1 3.53Å; F49-Y212 HydrophobicContact CZ-CE1 3.53Å; F49-Y212 HydrophobicContact CZ-CE2 4.07Å; F49-Y212 AromaticContact CZ-CG 3.82Å; F49-Y212 HydrophobicContact CZ-CG 3.82Å; F49-Y212 AromaticContact CZ-CZ 3.78Å; F120-Y212 HydrophobicContact CB-CD2 3.88Å; F120-Y212 AromaticContact CD1-CD2 3.5Å; F120-Y212 HydrophobicContact CD1-CD2 3.5Å; F120-Y212 VanDerWaalsContact CD1-CD2 3.5Å; F120-Y212 HydrophobicContact CD1-CE2 4.36Å; F120-Y212 AromaticContact CD1-CG 3.95Å; F120-Y212 HydrophobicContact CD1-CG 3.95Å; F120-Y212 HydrophobicContact CE1-CD2 4.13Å; F120-Y212 HydrophobicContact CE1-CG 4.15Å; F120-Y212 AromaticContact CG-CD2 3.73Å; F120-Y212 HydrophobicContact CG-CD2 3.73Å; F120-Y212 HydrophobicContact CG-CG 4.21Å; Q180-Y212 PolarHBondContact NE2-O 3.18Å; A183-Y212 WeakPolarHBondContact CB-O 3.37Å; L184-Y212 HydrophobicContact CD2-CD1 3.85Å; L184-Y212 HydrophobicContact CD2-CE1 4.04Å; Y212-P214 HydrophobicContact CE1-CB 3.84Å; Y212-P214 HydrophobicContact CE1-CG 4.22Å
213	V	93.1	Very high	87.8	Confident	19 Å²	19	44.8 Å²	44.8	12%	0.115	23%	0.23	C	C	.	.			trans	-121.9	108.2	175.9	-171.5	0	0	0	0	107.7	A183 A188 F191 V207 I211	A183-V213 HydrophobicContact CB-CG2 4.02Å; A188-V213 HydrophobicContact CB-CG1 4.05Å; F191-V213 HydrophobicContact CB-CG1 4.14Å; F191-V213 HydrophobicContact CD1-CG1 4.13Å; F191-V213 HydrophobicContact CD1-CG2 3.78Å; F191-V213 HydrophobicContact CE1-CG2 3.72Å; F191-V213 HydrophobicContact CG-CG1 4.24Å; F191-V213 HydrophobicContact CG-CG2 4.48Å; F191-V213 HydrophobicContact CZ-CG2 4.38Å; V207-V213 HydrophobicContact CG2-CB 4.42Å; V207-V213 HydrophobicContact CG2-CG2 3.77Å; I211-V213 HydrophobicContact CG2-CG2 4.25Å
214	P	91	Very high	86.7	Confident	7 Å²	7	46.1 Å²	46.1	5%	0.045	25%	0.248	C	C	.	.			trans	-75.3	141.7	-179	29.8	-33.6	0	0	0	111.2	L184 G187 A188 Y212 R216	L184-P214 HydrophobicContact CD2-CG 4.1Å; G187-P214 WeakPolarHBondContact CA-O 3.19Å; A188-P214 PolarHBondContact N-O 3.13Å; Y212-P214 HydrophobicContact CE1-CB 3.84Å; Y212-P214 HydrophobicContact CE1-CG 4.22Å; P214-R216 HydrophobicContact CB-CG 4.06Å; P214-R216 HydrophobicContact CG-CG 4.05Å; P214-R216 PolarHBondContact O-N 2.98Å
215	T	87.4	Confident	85.5	Confident	59 Å²	59	46.5 Å²	46.5	36%	0.362	26%	0.257	S	S	.	.	S	Bend	trans	-76.9	91	169.1	-55.6	0	0	0	0	109.2	Y189 P419	Y189-T215 HydrophobicContact CE2-CG2 4.33Å; T215-P419 WeakPolarHBondContact OG1-CD 3.34Å; T215-P419 WeakPolarHBondContact OG1-CG 3.49Å
216	R	83.1	Confident	84.1	Confident	64 Å²	64	49.3 Å²	49.3	24%	0.242	26%	0.263	C	S	.	.	S	Bend	trans	-159.1	164.6	173.1	57	176.8	168.5	69.5	-2.8	110	E30 L184 G187 Y189 P214	E30-R216 IonicContact OE2-CZ 3.5Å; E30-R216 IonicContact OE2-NE 3.48Å; E30-R216 PolarHBondContact OE2-NE 3.22Å; E30-R216 IonicContact OE2-NH2 2.71Å; E30-R216 PolarHBondContact OE2-NH2 3.09Å; L184-R216 PolarHBondContact O-NH1 2.93Å; L184-R216 PolarHBondContact O-NH2 3.07Å; G187-R216 WeakPolarHBondContact CA-O 3.48Å; Y189-R216 VanDerWaalsContact CD2-O 3.28Å; Y189-R216 WeakPolarHBondContact CD2-O 3.22Å; P214-R216 HydrophobicContact CB-CG 4.06Å; P214-R216 HydrophobicContact CG-CG 4.05Å; P214-R216 PolarHBondContact O-N 2.98Å
217	D	84.4	Confident	82.9	Confident	54 Å²	54	53 Å²	53	29%	0.289	28%	0.282	S	S	.	.			trans	-63.8	163.2	169.7	-152.7	-8.1	0	0	0	110.8	Y190 N221	Y190-D217 WeakPolarHBondContact CE2-OD1 3.44Å; D217-N221 HydrophobicContact CB-CB 4.5Å; D217-N221 PolarHBondContact OD1-ND2 2.95Å; D217-N221 WeakPolarHBondContact OD2-CB 3.41Å; D217-N221 PolarHBondContact OD2-ND2 3.47Å
218	C	82.9	Confident	81.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.308	C	S	.	.			trans	-59.4	145.8	175.5	-64.2	0	0	0	0	111.3	E185 S186 Y190 W220 N221 T222	E185-C218 CarbonylContact O-C 3.54Å; E185-C218 VanDerWaalsContact O-CA 3.32Å; E185-C218 WeakPolarHBondContact O-CA 3.46Å; S186-C218 PolarHBondContact O-SG 3.02Å; Y190-C218 WeakPolarHBondContact CB-SG 3.48Å; Y190-C218 HydrophobicContact CD2-CB 4.46Å; Y190-C218 WeakPolarHBondContact CD2-SG 3.39Å; C218-W220 HydrophobicContact CB-CD2 3.39Å; C218-W220 HydrophobicContact CB-CE3 3.87Å; C218-W220 HydrophobicContact CB-CG 3.83Å; C218-W220 HydrophobicContact CB-CH2 3.99Å; C218-W220 HydrophobicContact CB-CZ2 3.54Å; C218-W220 HydrophobicContact CB-CZ3 4.13Å; C218-W220 PolarHBondContact O-N 3.36Å; C218-W220 VanDerWaalsContact O-N 3.16Å; C218-W220 WeakPolarHBondContact SG-CH2 3.22Å; C218-W220 WeakPolarHBondContact SG-CZ2 3.35Å; C218-N221 WeakPolarHBondContact O-CB 3.37Å; C218-N221 PolarHBondContact O-N 3.5Å; C218-T222 PolarHBondContact O-N 3.12Å
219	S	83.6	Confident	80.6	Confident	26 Å²	26	61.5 Å²	61.5	18%	0.182	32%	0.324	C	S	.	.	H	α-helix	trans	-57.7	-34	175.9	71.5	0	0	0	0	111.4	E185 N221 T222 D223	E185-S219 PolarHBondContact O-N 3.47Å; S219-N221 PolarHBondContact O-N 3Å; S219-T222 WeakPolarHBondContact CA-OG1 3.09Å; S219-T222 CarbonylContact O-C 3.49Å; S219-T222 PolarHBondContact O-N 3.11Å; S219-T222 PolarHBondContact O-OG1 3.44Å; S219-D223 WeakPolarHBondContact O-CB 3.33Å; S219-D223 PolarHBondContact O-N 3.43Å
220	W	75.7	Confident	79.5	Confident	95 Å²	95	66 Å²	66	36%	0.36	35%	0.35	S	S	.	.	H	α-helix	trans	-67.9	-17.5	177	61.3	71.9	0	0	0	114.7	C218 Y226	C218-W220 HydrophobicContact CB-CD2 3.39Å; C218-W220 HydrophobicContact CB-CE3 3.87Å; C218-W220 HydrophobicContact CB-CG 3.83Å; C218-W220 HydrophobicContact CB-CH2 3.99Å; C218-W220 HydrophobicContact CB-CZ2 3.54Å; C218-W220 HydrophobicContact CB-CZ3 4.13Å; C218-W220 PolarHBondContact O-N 3.36Å; C218-W220 VanDerWaalsContact O-N 3.16Å; C218-W220 WeakPolarHBondContact SG-CH2 3.22Å; C218-W220 WeakPolarHBondContact SG-CZ2 3.35Å; W220-Y226 HydrophobicContact CB-CD2 3.7Å; W220-Y226 HydrophobicContact CB-CE2 3.92Å; W220-Y226 HydrophobicContact CB-CG 4.07Å; W220-Y226 WeakPolarHBondContact O-CB 3.15Å
221	N	72.4	Confident	78.5	Confident	72 Å²	72	72.5 Å²	72.5	39%	0.385	38%	0.38	S	S	.	.	H	α-helix	trans	-85.4	-22.7	171.9	-75.8	-3.8	0	0	0	111.7	D217 C218 S219	D217-N221 HydrophobicContact CB-CB 4.5Å; D217-N221 PolarHBondContact OD1-ND2 2.95Å; D217-N221 WeakPolarHBondContact OD2-CB 3.41Å; D217-N221 PolarHBondContact OD2-ND2 3.47Å; C218-N221 WeakPolarHBondContact O-CB 3.37Å; C218-N221 PolarHBondContact O-N 3.5Å; S219-N221 PolarHBondContact O-N 3Å
222	T	72	Confident	77.8	Confident	99 Å²	99	80.2 Å²	80.2	61%	0.607	41%	0.409	S	S	*	.	H	α-helix	trans	-97.7	-28.9	-179.8	56.6	0	0	0	0	113.3	C218 S219 A224	C218-T222 PolarHBondContact O-N 3.12Å; S219-T222 WeakPolarHBondContact CA-OG1 3.09Å; S219-T222 CarbonylContact O-C 3.49Å; S219-T222 PolarHBondContact O-N 3.11Å; S219-T222 PolarHBondContact O-OG1 3.44Å; T222-A224 PolarHBondContact O-N 2.87Å
223	D	71.7	Confident	77.1	Confident	66 Å²	66	79.7 Å²	79.7	35%	0.353	41%	0.41	S	S	.	.			trans	-76.5	119.7	-177.2	-66.6	-17.3	0	0	0	109.4	S219 D225 Y226	S219-D223 WeakPolarHBondContact O-CB 3.33Å; S219-D223 PolarHBondContact O-N 3.43Å; D223-D225 PolarHBondContact O-N 2.95Å; D223-Y226 HydrophobicContact CB-CD2 4.06Å; D223-Y226 HydrophobicContact CB-CE2 4.44Å; D223-Y226 PolarHBondContact O-N 2.63Å; D223-Y226 VanDerWaalsContact O-N 3.16Å
224	A	69.1	Low	76.8	Confident	68 Å²	68	80.8 Å²	80.8	56%	0.562	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-58.5	-21.5	-179.3	0	0	0	0	0	113.4	T222 Y226 N227	T222-A224 PolarHBondContact O-N 2.87Å; A224-Y226 PolarHBondContact O-N 2.65Å; A224-N227 VanDerWaalsContact O-CB 3.26Å; A224-N227 WeakPolarHBondContact O-CB 3.48Å; A224-N227 PolarHBondContact O-N 2.62Å; A224-N227 VanDerWaalsContact O-N 3.09Å
225	D	69.6	Low	76.8	Confident	141 Å²	141	86 Å²	86	75%	0.754	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-60.1	-25.9	179.2	-67.2	-12.3	0	0	0	113	D223	D223-D225 PolarHBondContact O-N 2.95Å
226	Y	65.9	Low	77.1	Confident	83 Å²	83	83.3 Å²	83.3	33%	0.325	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-98.5	2.4	179.2	-63.1	-77.7	0	0	0	113.6	W220 D223 A224 E228 L229	W220-Y226 HydrophobicContact CB-CD2 3.7Å; W220-Y226 HydrophobicContact CB-CE2 3.92Å; W220-Y226 HydrophobicContact CB-CG 4.07Å; W220-Y226 WeakPolarHBondContact O-CB 3.15Å; D223-Y226 HydrophobicContact CB-CD2 4.06Å; D223-Y226 HydrophobicContact CB-CE2 4.44Å; D223-Y226 PolarHBondContact O-N 2.63Å; D223-Y226 VanDerWaalsContact O-N 3.16Å; A224-Y226 PolarHBondContact O-N 2.65Å; Y226-E228 PolarHBondContact O-N 2.74Å; Y226-E228 VanDerWaalsContact O-N 3.09Å; Y226-L229 HydrophobicContact CD1-CD1 3.71Å; Y226-L229 WeakPolarHBondContact O-CB 3.4Å; Y226-L229 PolarHBondContact O-N 3.41Å
227	N	70.2	Confident	77.6	Confident	81 Å²	81	82.5 Å²	82.5	43%	0.433	44%	0.435	S	S	.	.	H	α-helix	trans	-59.2	-23.9	177.4	-77.9	-17.3	0	0	0	112.8	A224 L229 T230	A224-N227 VanDerWaalsContact O-CB 3.26Å; A224-N227 WeakPolarHBondContact O-CB 3.48Å; A224-N227 PolarHBondContact O-N 2.62Å; A224-N227 VanDerWaalsContact O-N 3.09Å; N227-L229 VanDerWaalsContact C-N 3.26Å; N227-L229 PolarHBondContact O-N 3.25Å; N227-T230 PolarHBondContact O-N 3.47Å; N227-T230 PolarHBondContact O-OG1 3.45Å
228	E	69.4	Low	77.9	Confident	155 Å²	155	81.1 Å²	81.1	72%	0.724	43%	0.429	S	S	*	.	H	α-helix	trans	-65.5	-30.3	173.6	-64.3	-172.6	175.1	0	0	112.4	Y226 T230 Q231	Y226-E228 PolarHBondContact O-N 2.74Å; Y226-E228 VanDerWaalsContact O-N 3.09Å; E228-T230 VanDerWaalsContact C-N 3.28Å; E228-T230 PolarHBondContact O-N 3.47Å; E228-Q231 PolarHBondContact O-N 3.05Å
229	L	71.2	Confident	78.1	Confident	144 Å²	144	85.9 Å²	85.9	75%	0.754	46%	0.462	S	S	*	.	H	α-helix	trans	-73.2	-21.4	178.2	-59.5	-178.8	0	0	0	112.8	Y226 N227 Q231	Y226-L229 HydrophobicContact CD1-CD1 3.71Å; Y226-L229 WeakPolarHBondContact O-CB 3.4Å; Y226-L229 PolarHBondContact O-N 3.41Å; N227-L229 VanDerWaalsContact C-N 3.26Å; N227-L229 PolarHBondContact O-N 3.25Å; L229-Q231 VanDerWaalsContact C-N 3.34Å
230	T	71.4	Confident	78.5	Confident	109 Å²	109	88.6 Å²	88.6	67%	0.669	48%	0.477	S	S	*	.	H	α-helix	trans	-82.9	-15.5	175.1	66.7	0	0	0	0	112	N227 E228 R232	N227-T230 PolarHBondContact O-N 3.47Å; N227-T230 PolarHBondContact O-OG1 3.45Å; E228-T230 VanDerWaalsContact C-N 3.28Å; E228-T230 PolarHBondContact O-N 3.47Å; T230-R232 PolarHBondContact O-N 3.34Å
231	Q	73.7	Confident	79.3	Confident	138 Å²	138	85.4 Å²	85.4	65%	0.645	47%	0.469	S	S	*	.	S	Bend	trans	-75	119.4	176.9	-64.8	-178.9	20.7	0	0	111	E228 L229	E228-Q231 PolarHBondContact O-N 3.05Å; L229-Q231 VanDerWaalsContact C-N 3.34Å
232	R	80.6	Confident	80.2	Confident	164 Å²	164	88.6 Å²	88.6	62%	0.619	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-72.9	140.3	172	-76.6	-175.4	176.1	-103.5	1.5	110.5	T230 G234 F259	T230-R232 PolarHBondContact O-N 3.34Å; R232-G234 PolarHBondContact O-N 3.42Å; R232-F259 HydrophobicContact CB-CE1 3.8Å; R232-F259 HydrophobicContact CB-CZ 3.88Å; R232-F259 HydrophobicContact CG-CE1 4.24Å; R232-F259 HydrophobicContact CG-CZ 4.18Å; R232-F259 VanDerWaalsContact NH1-CE2 3.28Å
233	P	81.7	Confident	81	Confident	30 Å²	30	84.4 Å²	84.4	20%	0.195	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-56	122.8	176.2	-22.3	28.4	0	0	0	112.1	A267	P233-A267 HydrophobicContact CB-CB 3.91Å; P233-A267 WeakPolarHBondContact O-CB 3.4Å
234	G	86.2	Confident	81.9	Confident	41 Å²	41	91.1 Å²	91.1	42%	0.423	48%	0.481	S	S	.	.			trans	-91.4	10.6	-177	0	0	0	0	0	115.5	R232	R232-G234 PolarHBondContact O-N 3.42Å
235	F	91.2	Very high	82.9	Confident	118 Å²	118	93 Å²	93	52%	0.518	48%	0.481	S	S	.	.	S	Bend	trans	-143.8	155.5	-174.9	61.1	-91.3	0	0	0	113.6	S237 R247	F235-S237 PolarHBondContact O-N 3.09Å; F235-R247 CarbonylContact C-O 3.55Å; F235-R247 VanDerWaalsContact CA-O 3.27Å; F235-R247 WeakPolarHBondContact CA-O 3.36Å; F235-R247 HydrophobicContact CB-CB 4.47Å
236	C	93.9	Very high	83.8	Confident	1 Å²	1	87.8 Å²	87.8	1%	0.007	46%	0.461	C	S	.	.	B	Isolated β-bridge	trans	-75.8	114.6	176.5	-176.5	0	0	0	0	112.3	R247 A267 H269	C236-R247 HydrophobicContact CB-CB 4.43Å; C236-R247 PolarHBondContact N-O 3.4Å; C236-R247 PolarHBondContact O-NH1 3.27Å; C236-A267 WeakPolarHBondContact CA-O 3.32Å; C236-H269 VanDerWaalsContact CB-ND1 3.3Å; C236-H269 WeakPolarHBondContact CB-ND1 3.35Å
237	S	92.4	Very high	85.2	Confident	48 Å²	48	88.9 Å²	88.9	34%	0.336	46%	0.464	S	S	.	.			trans	-92.1	0.2	179.9	63	0	0	0	0	114.4	F235 A267	F235-S237 PolarHBondContact O-N 3.09Å; S237-A267 WeakPolarHBondContact CB-O 3.28Å; S237-A267 PolarHBondContact N-O 2.73Å; S237-A267 PolarHBondContact OG-O 2.89Å
238	V	90.5	Very high	86.2	Confident	25 Å²	25	89.3 Å²	89.3	15%	0.152	47%	0.474	C	S	.	.	S	Bend	trans	-62.8	142.8	176.1	-175.1	0	0	0	0	109.7	V240 R247 A268 C272 I273 F278	V238-V240 VanDerWaalsContact C-N 3.26Å; V238-V240 WeakPolarHBondContact CG1-O 3.49Å; V238-V240 PolarHBondContact O-N 3.06Å; V238-R247 PolarHBondContact O-NH1 2.98Å; V238-A268 HydrophobicContact CG2-CB 3.33Å; V238-C272 HydrophobicContact CB-CB 4.26Å; V238-C272 HydrophobicContact CG2-CB 3.96Å; V238-I273 HydrophobicContact CG2-CG2 4.39Å; V238-F278 HydrophobicContact CG2-CE2 3.95Å; V238-F278 HydrophobicContact CG2-CZ 4.43Å
239	S	88.3	Confident	87.2	Confident	100 Å²	100	84.6 Å²	84.6	70%	0.699	45%	0.452	S	S	*	.	S	Bend	trans	-49.6	-48.2	178.8	49.4	0	0	0	0	111.8	R247	S239-R247 PolarHBondContact O-NH2 2.79Å; S239-R247 VanDerWaalsContact O-NH2 3.08Å
240	V	90.7	Very high	87.9	Confident	83 Å²	83	82 Å²	82	50%	0.503	44%	0.441	S	S	.	.	S	Bend	trans	-112.7	116.3	175.5	-174.9	0	0	0	0	109.9	V238 F242	V238-V240 VanDerWaalsContact C-N 3.26Å; V238-V240 WeakPolarHBondContact CG1-O 3.49Å; V238-V240 PolarHBondContact O-N 3.06Å; V240-F242 HydrophobicContact CG1-CD1 4.43Å; V240-F242 HydrophobicContact CG1-CE1 3.97Å; V240-F242 HydrophobicContact CG1-CE2 4.49Å; V240-F242 HydrophobicContact CG1-CZ 4Å
241	C	93.2	Very high	88.7	Confident	28 Å²	28	77.9 Å²	77.9	19%	0.189	42%	0.42	C	S	.	.			trans	-97.5	122.8	175.7	-177.2	0	0	0	0	109.8	C243 R247	C241-C243 VanDerWaalsContact SG-CB 3.56Å; C241-C243 PolarHBondContact SG-N 3.11Å; C241-R247 HydrophobicContact CB-CG 3.89Å
242	F	90.6	Very high	89.4	Confident	138 Å²	138	80.9 Å²	80.9	61%	0.605	43%	0.431	S	S	*	.			trans	-93.3	10.5	176.2	-49	-86.9	0	0	0	113.4	V240 K244 L271 C272	V240-F242 HydrophobicContact CG1-CD1 4.43Å; V240-F242 HydrophobicContact CG1-CE1 3.97Å; V240-F242 HydrophobicContact CG1-CE2 4.49Å; V240-F242 HydrophobicContact CG1-CZ 4Å; F242-K244 PolarHBondContact O-N 3.23Å; F242-L271 HydrophobicContact CB-CD1 3.48Å; F242-L271 VanDerWaalsContact CB-CD1 3.48Å; F242-L271 HydrophobicContact CD2-CD1 4.5Å; F242-L271 HydrophobicContact CG-CD1 4.49Å; F242-C272 PolarHBondContact N-SG 3.4Å
243	C	90.1	Very high	89.8	Confident	12 Å²	12	75.6 Å²	75.6	8%	0.081	43%	0.428	C	S	.	.			trans	-75.8	117.3	176.7	-172.2	0	0	0	0	110.7	C241 N245 G246 L255 H269	C241-C243 VanDerWaalsContact SG-CB 3.56Å; C241-C243 PolarHBondContact SG-N 3.11Å; C243-N245 PolarHBondContact O-N 2.88Å; C243-G246 WeakPolarHBondContact CB-O 3.13Å; C243-G246 PolarHBondContact O-N 3.05Å; C243-G246 PolarHBondContact SG-O 3.49Å; C243-L255 HydrophobicContact CB-CD2 4.37Å; C243-L255 WeakPolarHBondContact SG-CD2 3.37Å; C243-H269 VanDerWaalsContact CB-CE1 3.45Å; C243-H269 WeakPolarHBondContact CB-CE1 3.49Å
244	K	90	Very high	90.2	Very high	207 Å²	207	82 Å²	82	90%	0.9	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-27	177.7	-62.9	-175.5	179.1	-176.5	0	113.4	F242 G246	F242-K244 PolarHBondContact O-N 3.23Å; K244-G246 VanDerWaalsContact C-N 3.29Å; K244-G246 PolarHBondContact O-N 3.43Å
245	N	89.2	Confident	90.3	Very high	107 Å²	107	82.5 Å²	82.5	57%	0.572	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	9.5	-178.2	-62.4	-2.4	0	0	0	112.7	C243 H249	C243-N245 PolarHBondContact O-N 2.88Å; N245-H249 HydrophobicContact CB-CB 3.68Å; N245-H249 VanDerWaalsContact CB-CD2 3.44Å; N245-H249 WeakPolarHBondContact CB-CD2 3.28Å; N245-H249 VanDerWaalsContact CB-CG 3.48Å; N245-H249 PolarHBondContact ND2-CD2 3.22Å; N245-H249 VanDerWaalsContact ND2-CD2 3.33Å; N245-H249 PolarHBondContact ND2-NE2 3.16Å; N245-H249 VanDerWaalsContact ND2-NE2 3.1Å
246	G	90.4	Very high	90.4	Very high	32 Å²	32	83.1 Å²	83.1	33%	0.33	45%	0.448	S	S	.	.			trans	91.1	174	-179.3	0	0	0	0	0	114.4	C243 K244 S248	C243-G246 WeakPolarHBondContact CB-O 3.13Å; C243-G246 PolarHBondContact O-N 3.05Å; C243-G246 PolarHBondContact SG-O 3.49Å; K244-G246 VanDerWaalsContact C-N 3.29Å; K244-G246 PolarHBondContact O-N 3.43Å; G246-S248 PolarHBondContact O-N 3.34Å
247	R	94.1	Very high	90.3	Very high	106 Å²	106	83.8 Å²	83.8	40%	0.4	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-29.5	-171.7	-68.5	176	177.1	-89.7	2.2	113.7	F235 C236 V238 S239 C241 H269	F235-R247 CarbonylContact C-O 3.55Å; F235-R247 VanDerWaalsContact CA-O 3.27Å; F235-R247 WeakPolarHBondContact CA-O 3.36Å; F235-R247 HydrophobicContact CB-CB 4.47Å; C236-R247 HydrophobicContact CB-CB 4.43Å; C236-R247 PolarHBondContact N-O 3.4Å; C236-R247 PolarHBondContact O-NH1 3.27Å; V238-R247 PolarHBondContact O-NH1 2.98Å; S239-R247 PolarHBondContact O-NH2 2.79Å; S239-R247 VanDerWaalsContact O-NH2 3.08Å; C241-R247 HydrophobicContact CB-CG 3.89Å; R247-H269 PolarHBondContact O-CE1 3.31Å
248	S	90.9	Very high	90.3	Very high	90 Å²	90	83.4 Å²	83.4	63%	0.629	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-3.1	-178	49.6	0	0	0	0	114.2	G246 V250	G246-S248 PolarHBondContact O-N 3.34Å; S248-V250 PolarHBondContact O-N 3.48Å
249	H	90.3	Very high	90.4	Very high	56 Å²	56	85 Å²	85	26%	0.259	45%	0.452	S	S	.	.			trans	-74.9	116.1	-178.1	176.8	-82.9	0	0	0	111.3	N245 H269	N245-H249 HydrophobicContact CB-CB 3.68Å; N245-H249 VanDerWaalsContact CB-CD2 3.44Å; N245-H249 WeakPolarHBondContact CB-CD2 3.28Å; N245-H249 VanDerWaalsContact CB-CG 3.48Å; N245-H249 PolarHBondContact ND2-CD2 3.22Å; N245-H249 VanDerWaalsContact ND2-CD2 3.33Å; N245-H249 PolarHBondContact ND2-NE2 3.16Å; N245-H249 VanDerWaalsContact ND2-NE2 3.1Å; H249-H269 PolarHBondContact O-CD2 3.31Å; H249-H269 PolarHBondContact O-NE2 3.49Å
250	V	87.5	Confident	90.6	Very high	89 Å²	89	80.5 Å²	80.5	54%	0.539	42%	0.42	S	S	.	.			trans	-104.4	112.1	174.8	-172.3	0	0	0	0	109.1	S248 L257	S248-V250 PolarHBondContact O-N 3.48Å; V250-L257 HydrophobicContact CG2-CD1 3.59Å; V250-L257 HydrophobicContact CG2-CG 4.08Å
251	G	86.6	Confident	90.6	Very high	22 Å²	22	81.4 Å²	81.4	23%	0.227	42%	0.418	C	S	.	.			trans	-119	-175	177.8	0	0	0	0	0	112.7	L255 K256	G251-L255 PolarHBondContact N-O 3.06Å; G251-L255 CarbonylContact O-C 3.42Å; G251-K256 VanDerWaalsContact O-CA 3.29Å; G251-K256 WeakPolarHBondContact O-CA 3.42Å; G251-K256 PolarHBondContact O-N 3.42Å
252	K	88.4	Confident	90.4	Very high	202 Å²	202	84 Å²	84	88%	0.878	43%	0.428	S	S	*	.	S	Bend	trans	-82.8	162.6	172	-64.4	-176.5	179.9	-178.1	0	111.4	K254 L255	K252-K254 PolarHBondContact O-N 3.06Å; K252-L255 PolarHBondContact O-N 2.75Å
253	G	89.3	Confident	90.3	Very high	53 Å²	53	80.6 Å²	80.6	55%	0.546	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	62.1	-121.1	173.3	0	0	0	0	0	113.8	L255 K256	G253-L255 PolarHBondContact O-N 2.97Å; G253-K256 VanDerWaalsContact O-CB 3.28Å; G253-K256 WeakPolarHBondContact O-CB 3.48Å; G253-K256 PolarHBondContact O-N 3.19Å; G253-K256 VanDerWaalsContact O-N 3.16Å
254	K	89.5	Confident	90.3	Very high	164 Å²	164	81.5 Å²	81.5	71%	0.713	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-64	-23.7	-178.9	-71.5	-173.4	-177.9	179.3	0	113.4	K252 K270 L271	K252-K254 PolarHBondContact O-N 3.06Å; K254-K270 PolarHBondContact O-N 2.99Å; K254-L271 HydrophobicContact CB-CB 4.13Å; K254-L271 WeakPolarHBondContact O-CB 3.46Å; K254-L271 WeakPolarHBondContact O-CD2 3.34Å; K254-L271 PolarHBondContact O-N 3.5Å
255	L	89.8	Confident	90.2	Very high	52 Å²	52	74 Å²	74	27%	0.272	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-90.7	3	178.8	-68.2	162.3	0	0	0	113.3	C243 G251 K252 G253 H269 L271	C243-L255 HydrophobicContact CB-CD2 4.37Å; C243-L255 WeakPolarHBondContact SG-CD2 3.37Å; G251-L255 PolarHBondContact N-O 3.06Å; G251-L255 CarbonylContact O-C 3.42Å; K252-L255 PolarHBondContact O-N 2.75Å; G253-L255 PolarHBondContact O-N 2.97Å; L255-H269 PolarHBondContact O-CD2 2.95Å; L255-L271 HydrophobicContact CD2-CD2 3.29Å; L255-L271 HydrophobicContact CG-CD2 3.92Å
256	K	92.6	Very high	90.3	Very high	131 Å²	131	70.3 Å²	70.3	57%	0.57	40%	0.397	S	S	*	.	S	Bend	trans	-69.7	139.7	172.8	-173.9	176.2	178.8	177.4	0	109.6	G251 G253 H269 K270	G251-K256 VanDerWaalsContact O-CA 3.29Å; G251-K256 WeakPolarHBondContact O-CA 3.42Å; G251-K256 PolarHBondContact O-N 3.42Å; G253-K256 VanDerWaalsContact O-CB 3.28Å; G253-K256 WeakPolarHBondContact O-CB 3.48Å; G253-K256 PolarHBondContact O-N 3.19Å; G253-K256 VanDerWaalsContact O-N 3.16Å; K256-H269 WeakPolarHBondContact O-CA 3.19Å; K256-K270 PolarHBondContact O-N 3.31Å
257	L	92.6	Very high	90.5	Very high	14 Å²	14	68.9 Å²	68.9	7%	0.073	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	131.6	170.4	-70.1	178.4	0	0	0	110.3	V250 A267 A268	V250-L257 HydrophobicContact CG2-CD1 3.59Å; V250-L257 HydrophobicContact CG2-CG 4.08Å; L257-A267 HydrophobicContact CB-CB 4.24Å; L257-A267 HydrophobicContact CD1-CB 4.19Å; L257-A267 HydrophobicContact CD2-CB 4.15Å; L257-A267 HydrophobicContact CG-CB 4.43Å; L257-A268 CarbonylContact C-O 3.59Å; L257-A268 WeakPolarHBondContact CA-O 3.39Å
258	V	92.5	Very high	90.4	Very high	41 Å²	41	63.8 Å²	63.8	25%	0.248	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	146.1	167.3	-64.1	0	0	0	0	108.4	A267 A268 K270 I273 F278	V258-A267 CarbonylContact O-C 3.51Å; V258-A267 VanDerWaalsContact O-CA 3.29Å; V258-A267 WeakPolarHBondContact O-CA 3.34Å; V258-A268 HydrophobicContact CG2-CB 4.36Å; V258-A268 VanDerWaalsContact CG2-O 3.31Å; V258-A268 WeakPolarHBondContact CG2-O 3.35Å; V258-A268 PolarHBondContact N-O 2.79Å; V258-A268 PolarHBondContact O-N 3.36Å; V258-K270 HydrophobicContact CG1-CB 4.37Å; V258-I273 HydrophobicContact CG2-CD1 3.84Å; V258-F278 HydrophobicContact CG2-CB 4.06Å
259	F	92.7	Very high	90.6	Very high	59 Å²	59	59.5 Å²	59.5	26%	0.259	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	157.6	-174.6	-58.8	-82.6	0	0	0	111.2	R232 F261 S266 A267	R232-F259 HydrophobicContact CB-CE1 3.8Å; R232-F259 HydrophobicContact CB-CZ 3.88Å; R232-F259 HydrophobicContact CG-CE1 4.24Å; R232-F259 HydrophobicContact CG-CZ 4.18Å; R232-F259 VanDerWaalsContact NH1-CE2 3.28Å; F259-F261 PolarHBondContact O-N 3.44Å; F259-S266 CarbonylContact C-O 3.59Å; F259-S266 VanDerWaalsContact CA-O 3.32Å; F259-S266 WeakPolarHBondContact CA-O 3.03Å; F259-A267 HydrophobicContact CD1-CB 3.89Å; F259-A267 HydrophobicContact CE1-CB 3.88Å
260	C	92.5	Very high	90.7	Very high	4 Å²	4	63 Å²	63	3%	0.027	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-58	127.3	174.2	177.5	0	0	0	0	108.7	I262 C263 G264 S266 F278 C280	C260-I262 PolarHBondContact O-N 3.05Å; C260-C263 VanDerWaalsContact CB-SG 3.6Å; C260-C263 VanDerWaalsContact SG-SG 3.66Å; C260-G264 VanDerWaalsContact O-CA 3.32Å; C260-G264 WeakPolarHBondContact O-CA 3.47Å; C260-G264 PolarHBondContact O-N 3.36Å; C260-S266 PolarHBondContact N-O 2.99Å; C260-F278 CarbonylContact C-O 3.55Å; C260-F278 VanDerWaalsContact CA-O 3.29Å; C260-F278 WeakPolarHBondContact CA-O 3.03Å; C260-F278 HydrophobicContact CB-CD1 4.15Å; C260-F278 HydrophobicContact CB-CE1 4.16Å; C260-C280 HydrophobicContact CB-CB 4.14Å; C260-C280 PolarHBondContact SG-N 3.39Å
261	F	90.4	Very high	90.9	Very high	103 Å²	103	61.1 Å²	61.1	45%	0.452	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-29.3	-174	-175	-108.3	0	0	0	113.2	F259 R277 F278 Y279 E290	F259-F261 PolarHBondContact O-N 3.44Å; F261-R277 HydrophobicContact CB-CB 4.34Å; F261-R277 HydrophobicContact CD2-CG 4.28Å; F261-R277 HydrophobicContact CG-CG 4.42Å; F261-F278 PolarHBondContact N-O 2.91Å; F261-Y279 HydrophobicContact CB-CE1 4.17Å; F261-Y279 HydrophobicContact CD1-CE1 4.21Å; F261-E290 WeakPolarHBondContact CE1-OE1 3.13Å
262	I	88.9	Confident	91.2	Very high	81 Å²	81	60.4 Å²	60.4	42%	0.415	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-56.2	-176.3	-61.5	-177.1	0	0	0	111.3	C260 Y279 C283 Y286	C260-I262 PolarHBondContact O-N 3.05Å; I262-Y279 HydrophobicContact CD1-CD1 3.86Å; I262-Y279 HydrophobicContact CD1-CE1 3.91Å; I262-Y279 HydrophobicContact CG1-CD1 4.02Å; I262-Y279 HydrophobicContact CG1-CE1 3.98Å; I262-C283 HydrophobicContact CB-CB 4.03Å; I262-C283 HydrophobicContact CD1-CB 4.2Å; I262-C283 HydrophobicContact CG2-CB 4.47Å; I262-Y286 HydrophobicContact CD1-CG 4.23Å
263	C	88.9	Confident	91.3	Very high	67 Å²	67	52.5 Å²	52.5	45%	0.453	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-19.6	-172.4	69.4	0	0	0	0	114.6	C260 G265	C260-C263 VanDerWaalsContact CB-SG 3.6Å; C260-C263 VanDerWaalsContact SG-SG 3.66Å; C263-G265 PolarHBondContact O-N 3.12Å; C263-G265 PolarHBondContact SG-N 3.12Å
264	G	89.1	Confident	91.1	Very high	31 Å²	31	57.6 Å²	57.6	32%	0.32	31%	0.313	S	S	.	.	S	Bend	trans	65	-20.9	-170.5	0	0	0	0	0	115.6	C260 S266	C260-G264 VanDerWaalsContact O-CA 3.32Å; C260-G264 WeakPolarHBondContact O-CA 3.47Å; C260-G264 PolarHBondContact O-N 3.36Å; G264-S266 PolarHBondContact O-N 3.02Å
265	G	87.7	Confident	90.8	Very high	51 Å²	51	52 Å²	52	53%	0.526	30%	0.301	S	S	.	.	S	Bend	trans	-75.8	10.9	-173	0	0	0	0	0	115.9	C263	C263-G265 PolarHBondContact O-N 3.12Å; C263-G265 PolarHBondContact SG-N 3.12Å
266	S	92	Very high	90.6	Very high	29 Å²	29	59.9 Å²	59.9	20%	0.203	33%	0.334	C	S	.	.			trans	-140.5	142.3	173.3	-68.1	0	0	0	0	108.8	F259 C260 G264 F278	F259-S266 CarbonylContact C-O 3.59Å; F259-S266 VanDerWaalsContact CA-O 3.32Å; F259-S266 WeakPolarHBondContact CA-O 3.03Å; C260-S266 PolarHBondContact N-O 2.99Å; G264-S266 PolarHBondContact O-N 3.02Å; S266-F278 WeakPolarHBondContact O-CE1 3.2Å
267	A	93.3	Very high	90.5	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.008	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	154.7	176	0	0	0	0	0	111.6	P233 C236 S237 L257 V258 F259	P233-A267 HydrophobicContact CB-CB 3.91Å; P233-A267 WeakPolarHBondContact O-CB 3.4Å; C236-A267 WeakPolarHBondContact CA-O 3.32Å; S237-A267 WeakPolarHBondContact CB-O 3.28Å; S237-A267 PolarHBondContact N-O 2.73Å; S237-A267 PolarHBondContact OG-O 2.89Å; L257-A267 HydrophobicContact CB-CB 4.24Å; L257-A267 HydrophobicContact CD1-CB 4.19Å; L257-A267 HydrophobicContact CD2-CB 4.15Å; L257-A267 HydrophobicContact CG-CB 4.43Å; V258-A267 CarbonylContact O-C 3.51Å; V258-A267 VanDerWaalsContact O-CA 3.29Å; V258-A267 WeakPolarHBondContact O-CA 3.34Å; F259-A267 HydrophobicContact CD1-CB 3.89Å; F259-A267 HydrophobicContact CE1-CB 3.88Å
268	A	93.2	Very high	90.4	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	146.2	174	0	0	0	0	0	108.5	V238 L257 V258 I273 F278	V238-A268 HydrophobicContact CG2-CB 3.33Å; L257-A268 CarbonylContact C-O 3.59Å; L257-A268 WeakPolarHBondContact CA-O 3.39Å; V258-A268 HydrophobicContact CG2-CB 4.36Å; V258-A268 VanDerWaalsContact CG2-O 3.31Å; V258-A268 WeakPolarHBondContact CG2-O 3.35Å; V258-A268 PolarHBondContact N-O 2.79Å; V258-A268 PolarHBondContact O-N 3.36Å; A268-I273 HydrophobicContact CB-CG2 3.59Å; A268-F278 HydrophobicContact CB-CB 4.48Å; A268-F278 HydrophobicContact CB-CD1 3.67Å; A268-F278 HydrophobicContact CB-CD2 3.73Å; A268-F278 HydrophobicContact CB-CE1 3.79Å; A268-F278 HydrophobicContact CB-CE2 3.83Å; A268-F278 HydrophobicContact CB-CG 3.68Å; A268-F278 HydrophobicContact CB-CZ 3.87Å
269	H	94.8	Very high	90.4	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	144.8	165.5	-60.3	116.8	0	0	0	109.5	C236 C243 R247 H249 L255 K256 L271 C272	C236-H269 VanDerWaalsContact CB-ND1 3.3Å; C236-H269 WeakPolarHBondContact CB-ND1 3.35Å; C243-H269 VanDerWaalsContact CB-CE1 3.45Å; C243-H269 WeakPolarHBondContact CB-CE1 3.49Å; R247-H269 PolarHBondContact O-CE1 3.31Å; H249-H269 PolarHBondContact O-CD2 3.31Å; H249-H269 PolarHBondContact O-NE2 3.49Å; L255-H269 PolarHBondContact O-CD2 2.95Å; K256-H269 WeakPolarHBondContact O-CA 3.19Å; H269-L271 HydrophobicContact CB-CD2 4Å; H269-L271 HydrophobicContact CB-CG 3.76Å; H269-L271 PolarHBondContact O-N 3.14Å; H269-L271 VanDerWaalsContact O-N 3.13Å; H269-C272 HydrophobicContact CB-CB 4.15Å; H269-C272 WeakPolarHBondContact O-CA 3.49Å; H269-C272 WeakPolarHBondContact O-CB 3.34Å; H269-C272 PolarHBondContact O-N 2.95Å
270	K	92.4	Very high	90.3	Very high	129 Å²	129	56.9 Å²	56.9	56%	0.561	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-55.2	-31.1	173.5	-170.9	175.2	-177.7	177.7	0	112.2	K254 K256 V258 C272 I273	K254-K270 PolarHBondContact O-N 2.99Å; K256-K270 PolarHBondContact O-N 3.31Å; V258-K270 HydrophobicContact CG1-CB 4.37Å; K270-C272 VanDerWaalsContact C-N 3.34Å; K270-I273 WeakPolarHBondContact O-CG1 3.44Å
271	L	92.6	Very high	90.1	Very high	50 Å²	50	61.3 Å²	61.3	26%	0.262	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-73.2	-20.5	174.2	73.3	97.8	0	0	0	114.6	F242 K254 L255 H269	F242-L271 HydrophobicContact CB-CD1 3.48Å; F242-L271 VanDerWaalsContact CB-CD1 3.48Å; F242-L271 HydrophobicContact CD2-CD1 4.5Å; F242-L271 HydrophobicContact CG-CD1 4.49Å; K254-L271 HydrophobicContact CB-CB 4.13Å; K254-L271 WeakPolarHBondContact O-CB 3.46Å; K254-L271 WeakPolarHBondContact O-CD2 3.34Å; K254-L271 PolarHBondContact O-N 3.5Å; L255-L271 HydrophobicContact CD2-CD2 3.29Å; L255-L271 HydrophobicContact CG-CD2 3.92Å; H269-L271 HydrophobicContact CB-CD2 4Å; H269-L271 HydrophobicContact CB-CG 3.76Å; H269-L271 PolarHBondContact O-N 3.14Å; H269-L271 VanDerWaalsContact O-N 3.13Å
272	C	93	Very high	89.9	Confident	7 Å²	7	64.1 Å²	64.1	5%	0.047	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-91.7	-0.3	-176.2	-66.1	0	0	0	0	112.9	V238 F242 H269 K270	V238-C272 HydrophobicContact CB-CB 4.26Å; V238-C272 HydrophobicContact CG2-CB 3.96Å; F242-C272 PolarHBondContact N-SG 3.4Å; H269-C272 HydrophobicContact CB-CB 4.15Å; H269-C272 WeakPolarHBondContact O-CA 3.49Å; H269-C272 WeakPolarHBondContact O-CB 3.34Å; H269-C272 PolarHBondContact O-N 2.95Å; K270-C272 VanDerWaalsContact C-N 3.34Å
273	I	90.5	Very high	89.9	Confident	35 Å²	35	60.7 Å²	60.7	18%	0.179	34%	0.342	C	S	.	.			trans	-111.4	142.8	-179.8	59.2	163.5	0	0	0	110.2	V238 V258 A268 K270 G275 F278	V238-I273 HydrophobicContact CG2-CG2 4.39Å; V258-I273 HydrophobicContact CG2-CD1 3.84Å; A268-I273 HydrophobicContact CB-CG2 3.59Å; K270-I273 WeakPolarHBondContact O-CG1 3.44Å; I273-G275 WeakPolarHBondContact CD1-O 3.41Å; I273-F278 HydrophobicContact CG2-CB 4.01Å; I273-F278 HydrophobicContact CG2-CD2 3.72Å; I273-F278 HydrophobicContact CG2-CG 4.08Å
274	T	84.9	Confident	89.6	Confident	160 Å²	160	64.3 Å²	64.3	98%	0.982	35%	0.346	S	S	*	.	S	Bend	trans	-94.7	-10.9	-179.8	47.3	0	0	0	0	113.3
275	G	83.6	Confident	89.2	Confident	46 Å²	46	68.4 Å²	68.4	47%	0.474	36%	0.36	S	S	.	.	S	Bend	trans	-118.4	177.7	-177.9	0	0	0	0	0	114.2	I273 R277	I273-G275 WeakPolarHBondContact CD1-O 3.41Å; G275-R277 VanDerWaalsContact C-N 3.31Å; G275-R277 PolarHBondContact O-N 3.39Å
276	K	85.2	Confident	88.5	Confident	219 Å²	219	71.8 Å²	71.8	95%	0.952	36%	0.358	S	S	*	.	S	Bend	trans	-66.9	-30.9	176.4	-67.9	-174.7	179	-177.3	0	112.9
277	R	89.4	Confident	87.4	Confident	118 Å²	118	71.7 Å²	71.7	45%	0.445	36%	0.357	S	S	.	.	S	Bend	trans	-124	145.1	-178.7	-67.9	178.3	178.6	167.3	-1.4	110.5	F261 G275 Y279 E290	F261-R277 HydrophobicContact CB-CB 4.34Å; F261-R277 HydrophobicContact CD2-CG 4.28Å; F261-R277 HydrophobicContact CG-CG 4.42Å; G275-R277 VanDerWaalsContact C-N 3.31Å; G275-R277 PolarHBondContact O-N 3.39Å; R277-Y279 HydrophobicContact CB-CD2 4.5Å; R277-Y279 HydrophobicContact CB-CE2 3.74Å; R277-E290 IonicContact NH1-OE1 2.84Å; R277-E290 PolarHBondContact NH1-OE1 3.02Å; R277-E290 IonicContact NH1-OE2 3.7Å
278	F	91.3	Very high	86	Confident	17 Å²	17	76.6 Å²	76.6	8%	0.075	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-90.3	132	174.1	175.1	-131.4	0	0	0	110.4	V238 V258 C260 F261 S266 A268 I273 C280	V238-F278 HydrophobicContact CG2-CE2 3.95Å; V238-F278 HydrophobicContact CG2-CZ 4.43Å; V258-F278 HydrophobicContact CG2-CB 4.06Å; C260-F278 CarbonylContact C-O 3.55Å; C260-F278 VanDerWaalsContact CA-O 3.29Å; C260-F278 WeakPolarHBondContact CA-O 3.03Å; C260-F278 HydrophobicContact CB-CD1 4.15Å; C260-F278 HydrophobicContact CB-CE1 4.16Å; F261-F278 PolarHBondContact N-O 2.91Å; S266-F278 WeakPolarHBondContact O-CE1 3.2Å; A268-F278 HydrophobicContact CB-CB 4.48Å; A268-F278 HydrophobicContact CB-CD1 3.67Å; A268-F278 HydrophobicContact CB-CD2 3.73Å; A268-F278 HydrophobicContact CB-CE1 3.79Å; A268-F278 HydrophobicContact CB-CE2 3.83Å; A268-F278 HydrophobicContact CB-CG 3.68Å; A268-F278 HydrophobicContact CB-CZ 3.87Å; I273-F278 HydrophobicContact CG2-CB 4.01Å; I273-F278 HydrophobicContact CG2-CD2 3.72Å; I273-F278 HydrophobicContact CG2-CG 4.08Å; F278-C280 HydrophobicContact CZ-CB 4.19Å
279	Y	91.3	Very high	84.3	Confident	43 Å²	43	80.9 Å²	80.9	17%	0.169	41%	0.412	C	S	.	.			trans	-122.9	125.2	169.3	-58.6	-94.8	0	0	0	108.4	F261 I262 R277 E290	F261-Y279 HydrophobicContact CB-CE1 4.17Å; F261-Y279 HydrophobicContact CD1-CE1 4.21Å; I262-Y279 HydrophobicContact CD1-CD1 3.86Å; I262-Y279 HydrophobicContact CD1-CE1 3.91Å; I262-Y279 HydrophobicContact CG1-CD1 4.02Å; I262-Y279 HydrophobicContact CG1-CE1 3.98Å; R277-Y279 HydrophobicContact CB-CD2 4.5Å; R277-Y279 HydrophobicContact CB-CE2 3.74Å; Y279-E290 PolarHBondContact OH-OE2 2.92Å
280	C	90.6	Very high	82.4	Confident	4 Å²	4	85.1 Å²	85.1	3%	0.027	43%	0.432	C	S	.	.			trans	-68.6	169.2	176	75.7	0	0	0	0	110.7	C260 F278 Q282 C283 R284	C260-C280 HydrophobicContact CB-CB 4.14Å; C260-C280 PolarHBondContact SG-N 3.39Å; F278-C280 HydrophobicContact CZ-CB 4.19Å; C280-Q282 PolarHBondContact O-N 3.14Å; C280-C283 PolarHBondContact O-N 3.3Å; C280-C283 VanDerWaalsContact O-N 3.11Å; C280-C283 PolarHBondContact SG-N 3.12Å; C280-C283 VanDerWaalsContact SG-N 3.39Å; C280-R284 PolarHBondContact O-N 3.21Å
281	S	88.3	Confident	80.5	Confident	97 Å²	97	83.5 Å²	83.5	68%	0.678	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-36.2	-179.7	49.2	0	0	0	0	113.1
282	Q	86.8	Confident	78.8	Confident	161 Å²	161	89.7 Å²	89.7	75%	0.752	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-27.5	179.4	-62.5	177.3	-4.2	0	0	113.1	C280	C280-Q282 PolarHBondContact O-N 3.14Å
283	C	89.2	Confident	76.4	Confident	10 Å²	10	96.4 Å²	96.4	7%	0.068	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-4.8	-177.8	-67.6	0	0	0	0	113.4	I262 C280 D285 Y286	I262-C283 HydrophobicContact CB-CB 4.03Å; I262-C283 HydrophobicContact CD1-CB 4.2Å; I262-C283 HydrophobicContact CG2-CB 4.47Å; C280-C283 PolarHBondContact O-N 3.3Å; C280-C283 VanDerWaalsContact O-N 3.11Å; C280-C283 PolarHBondContact SG-N 3.12Å; C280-C283 VanDerWaalsContact SG-N 3.39Å; C283-D285 VanDerWaalsContact C-N 3.3Å; C283-D285 PolarHBondContact O-N 2.76Å; C283-Y286 PolarHBondContact O-N 3.45Å
284	R	83.4	Confident	73.9	Confident	142 Å²	142	104 Å²	104	54%	0.536	52%	0.522	S	S	.	.	H	α-helix	trans	-61.3	-39	-173.3	-169.1	178.1	-65.3	179.8	0.3	112.2	C280 Y286 S287	C280-R284 PolarHBondContact O-N 3.21Å; R284-Y286 PolarHBondContact O-N 3.3Å; R284-S287 WeakPolarHBondContact O-CB 3.49Å; R284-S287 PolarHBondContact O-N 3.43Å; R284-S287 PolarHBondContact O-OG 3.38Å
285	D	79.1	Confident	71.3	Confident	117 Å²	117	103.3 Å²	103.3	63%	0.626	52%	0.52	S	S	*	.	H	α-helix	trans	-64.2	-30	-177.3	-61.4	-20	0	0	0	112	C283 S287 L288	C283-D285 VanDerWaalsContact C-N 3.3Å; C283-D285 PolarHBondContact O-N 2.76Å; D285-S287 VanDerWaalsContact C-N 3.35Å; D285-S287 PolarHBondContact O-N 3.29Å; D285-L288 PolarHBondContact O-N 2.92Å
286	Y	74.3	Confident	69.1	Low	123 Å²	123	103.4 Å²	103.4	48%	0.482	52%	0.521	S	S	.	.	H	α-helix	trans	-73.3	-24	175.8	-59.1	-86	0	0	0	113.4	I262 C283 R284 L288 C289	I262-Y286 HydrophobicContact CD1-CG 4.23Å; C283-Y286 PolarHBondContact O-N 3.45Å; R284-Y286 PolarHBondContact O-N 3.3Å; Y286-L288 PolarHBondContact O-N 2.92Å; Y286-C289 WeakPolarHBondContact O-CB 3.36Å; Y286-C289 PolarHBondContact O-N 3.12Å; Y286-C289 VanDerWaalsContact O-N 3.11Å
287	S	68.1	Low	66.5	Low	26 Å²	26	99.9 Å²	99.9	18%	0.182	52%	0.518	C	S	.	.	H	α-helix	trans	-64.4	-24.8	176.2	74.3	0	0	0	0	112.9	R284 D285 C289 S291	R284-S287 WeakPolarHBondContact O-CB 3.49Å; R284-S287 PolarHBondContact O-N 3.43Å; R284-S287 PolarHBondContact O-OG 3.38Å; D285-S287 VanDerWaalsContact C-N 3.35Å; D285-S287 PolarHBondContact O-N 3.29Å; S287-C289 VanDerWaalsContact C-N 3.29Å; S287-C289 PolarHBondContact O-N 2.88Å; S287-S291 PolarHBondContact O-OG 3.24Å
288	L	63.7	Low	64	Low	105 Å²	105	101.7 Å²	101.7	55%	0.55	54%	0.535	S	S	.	.	H	α-helix	trans	-75.4	-19.4	177.3	-58.8	174.9	0	0	0	112.7	D285 Y286 S291	D285-L288 PolarHBondContact O-N 2.92Å; Y286-L288 PolarHBondContact O-N 2.92Å; L288-S291 PolarHBondContact O-OG 2.97Å
289	C	57.3	Low	61.5	Low	89 Å²	89	105.2 Å²	105.2	60%	0.601	56%	0.561	S	S	*	*	H	α-helix	trans	-81.4	-30.7	175.9	-67.4	0	0	0	0	112	Y286 S287 S291 K292	Y286-C289 WeakPolarHBondContact O-CB 3.36Å; Y286-C289 PolarHBondContact O-N 3.12Å; Y286-C289 VanDerWaalsContact O-N 3.11Å; S287-C289 VanDerWaalsContact C-N 3.29Å; S287-C289 PolarHBondContact O-N 2.88Å; C289-S291 VanDerWaalsContact C-N 3.26Å; C289-S291 PolarHBondContact O-N 3.15Å; C289-K292 PolarHBondContact O-N 3.11Å
290	E	55.2	Low	58.9	Low	90 Å²	90	108.5 Å²	108.5	42%	0.421	59%	0.59	S	S	.	*	H	α-helix	trans	-68.6	-25	178.6	-131.7	175.3	166.9	0	0	112.4	F261 R277 Y279	F261-E290 WeakPolarHBondContact CE1-OE1 3.13Å; R277-E290 IonicContact NH1-OE1 2.84Å; R277-E290 PolarHBondContact NH1-OE1 3.02Å; R277-E290 IonicContact NH1-OE2 3.7Å; Y279-E290 PolarHBondContact OH-OE2 2.92Å
291	S	53.7	Low	56.3	Low	95 Å²	95	115.5 Å²	115.5	66%	0.664	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-3.1	179.1	32.8	0	0	0	0	114.1	S287 L288 C289	S287-S291 PolarHBondContact O-OG 3.24Å; L288-S291 PolarHBondContact O-OG 2.97Å; C289-S291 VanDerWaalsContact C-N 3.26Å; C289-S291 PolarHBondContact O-N 3.15Å
292	K	55.8	Low	53.8	Low	179 Å²	179	119.9 Å²	119.9	78%	0.778	64%	0.637	S	S	*	*	S	Bend	trans	-115	1.6	-176.3	-70.2	-175.3	179	-179.6	0	115.1	C289	C289-K292 PolarHBondContact O-N 3.11Å
293	K	43.7	Very low	51.4	Low	149 Å²	149	117.2 Å²	117.2	65%	0.648	64%	0.637	S	S	*	*	S	Bend	trans	-137.7	133.2	177.2	-74.5	-176.8	175	-175.9	0	110.3
294	F	37.2	Very low	48.8	Very low	193 Å²	193	122.9 Å²	122.9	85%	0.846	67%	0.671	S	S	*	*			trans	93.9	84.5	-176	-63.7	-79	0	0	0	117.4	G296	F294-G296 PolarHBondContact O-N 3.13Å; F294-G296 VanDerWaalsContact O-N 3.15Å
295	P	31.1	Very low	46.3	Very low	147 Å²	147	125.2 Å²	125.2	96%	0.955	69%	0.688	S	S	*	*			trans	-77.8	77.5	146.5	33.8	-24.7	0	0	0	107.4
296	G	36.1	Very low	44.5	Very low	47 Å²	47	124.9 Å²	124.9	49%	0.485	70%	0.695	S	S	.	*			trans	-130.7	108.9	176.4	0	0	0	0	0	108.3	F294 I298	F294-G296 PolarHBondContact O-N 3.13Å; F294-G296 VanDerWaalsContact O-N 3.15Å; G296-I298 PolarHBondContact O-N 2.96Å; G296-I298 VanDerWaalsContact O-N 3.09Å
297	V	31.7	Very low	42.6	Very low	146 Å²	146	127.1 Å²	127.1	89%	0.885	71%	0.71	S	S	*	*			trans	-51.8	111	179.7	177.7	0	0	0	0	109.8
298	I	35.6	Very low	40.8	Very low	156 Å²	156	135 Å²	135	80%	0.8	74%	0.744	S	S	*	*			trans	-105.1	101.7	159.3	-60.4	176	0	0	0	104.6	G296 S300	G296-I298 PolarHBondContact O-N 2.96Å; G296-I298 VanDerWaalsContact O-N 3.09Å; I298-S300 PolarHBondContact O-N 2.83Å
299	S	39.8	Very low	39.4	Very low	90 Å²	90	135.9 Å²	135.9	63%	0.629	76%	0.759	S	S	*	*			trans	-57.6	134.8	173.3	53.2	0	0	0	0	109.2
300	S	35.5	Very low	38.2	Very low	112 Å²	112	140.7 Å²	140.7	78%	0.783	77%	0.772	S	S	*	*			trans	-88.5	105.1	-178.8	-52.7	0	0	0	0	107.9	I298	I298-S300 PolarHBondContact O-N 2.83Å
301	D	36.6	Very low	37.1	Very low	151 Å²	151	141.8 Å²	141.8	81%	0.807	79%	0.788	S	S	*	*			trans	-121.7	95.7	162.8	-69.2	-42.4	0	0	0	108.7
302	E	34.8	Very low	36.1	Very low	189 Å²	189	141.9 Å²	141.9	88%	0.883	79%	0.788	S	S	*	*			trans	-63	125.6	150	-85.6	-170.1	110.4	0	0	107.7
303	S	38.3	Very low	34.9	Very low	106 Å²	106	136.4 Å²	136.4	74%	0.741	78%	0.783	S	S	*	*				170.8	141.6	121.7	42.5	0	0	0	0	112.6
304	T	34.6	Very low	34.6	Very low	128 Å²	128	136.5 Å²	136.5	79%	0.785	79%	0.79	S	S	*	*			trans	73.9	109.7	145.8	38.6	0	0	0	0	120.8
305	E	30	Very low	34.3	Very low	192 Å²	192	135.4 Å²	135.4	90%	0.897	79%	0.793	S	S	*	*			trans	-33.6	127.8	151.2	-57.5	171	158.9	0	0	113.7
306	S	40.3	Very low	34.7	Very low	110 Å²	110	136.8 Å²	136.8	77%	0.769	79%	0.787	S	S	*	*			trans	-173.4	111.8	141.4	18.6	0	0	0	0	110.6
307	E	34.8	Very low	34.5	Very low	170 Å²	170	142.3 Å²	142.3	79%	0.794	81%	0.805	S	S	*	*			trans	39.7	108.6	131.7	-61.3	177.6	-175.5	0	0	119.5
308	E	30.2	Very low	34.7	Very low	192 Å²	192	141.7 Å²	141.7	90%	0.897	80%	0.802	S	S	*	*			trans	24.8	105.3	130.2	14.3	-168.2	146.9	0	0	117
309	S	34.9	Very low	34.5	Very low	123 Å²	123	141.8 Å²	141.8	86%	0.86	80%	0.804	S	S	*	*			trans	-161.6	148.1	142.9	44.4	0	0	0	0	112
310	E	32	Very low	34.4	Very low	190 Å²	190	143.2 Å²	143.2	89%	0.888	81%	0.814	S	S	*	*			trans	-64.7	146	-167.5	-58.1	160.6	147.4	0	0	113.1
311	C	31.5	Very low	34.2	Very low	112 Å²	112	143.5 Å²	143.5	76%	0.757	82%	0.816	S	S	*	*			trans	-151.9	104.8	145.3	-141	0	0	0	0	109.5
312	C	34.4	Very low	34.2	Very low	97 Å²	97	141.2 Å²	141.2	66%	0.655	82%	0.818	S	S	*	*				81.3	102.2	86.1	76.6	0	0	0	0	110.9
313	G	29.9	Very low	34	Very low	65 Å²	65	135.7 Å²	135.7	67%	0.67	81%	0.812	S	S	*	*			trans	-72.2	154.1	158.7	0	0	0	0	0	109.5
314	N	37.5	Very low	33.9	Very low	150 Å²	150	139.3 Å²	139.3	80%	0.802	82%	0.822	S	S	*	*			trans	-151.7	108	150.6	-85.8	-27.3	0	0	0	107.6
315	N	30.6	Very low	33.7	Very low	171 Å²	171	141.3 Å²	141.3	91%	0.914	83%	0.828	S	S	*	*			trans	-79.7	122.1	155.7	-86.4	-22.6	0	0	0	106.7
316	E	39.9	Very low	33.9	Very low	175 Å²	175	136 Å²	136	82%	0.818	82%	0.824	S	S	*	*			trans	-129.9	104.9	157.2	-71.3	-167.8	138.8	0	0	108.9
317	N	30.8	Very low	33.4	Very low	164 Å²	164	134.1 Å²	134.1	88%	0.877	82%	0.823	S	S	*	*			trans	-66	124.7	152.3	-82.5	-23.3	0	0	0	107.4
318	T	36	Very low	33.3	Very low	133 Å²	133	134.2 Å²	134.2	82%	0.816	83%	0.827	S	S	*	*			trans	-150.1	129.4	145.5	35.3	0	0	0	0	110.4
319	D	31.2	Very low	33.3	Very low	158 Å²	158	134.1 Å²	134.1	85%	0.845	83%	0.826	S	S	*	*			trans	-52.4	140.7	169.6	-66.6	-57.4	0	0	0	112
320	S	37.7	Very low	33	Very low	120 Å²	120	132 Å²	132	84%	0.839	82%	0.824	S	S	*	*			trans	-167.1	119.6	140.7	-83.7	0	0	0	0	111.9
321	S	32.2	Very low	33	Very low	118 Å²	118	127 Å²	127	83%	0.825	82%	0.815	S	S	*	*			trans	-47.5	137.2	166.2	49.8	0	0	0	0	115.3
322	A	36.8	Very low	33	Very low	103 Å²	103	129.9 Å²	129.9	85%	0.851	82%	0.823	S	S	*	*			trans	-168.7	124.1	135.2	0	0	0	0	0	109.2
323	G	30.3	Very low	32.9	Very low	73 Å²	73	133.3 Å²	133.3	75%	0.753	83%	0.83	S	S	*	*			trans	-76	-177.4	-169.5	0	0	0	0	0	115.8
324	L	35.6	Very low	33	Very low	181 Å²	181	140.2 Å²	140.2	95%	0.948	84%	0.841	S	S	*	*				-163.9	135.7	129.6	-95.1	170	0	0	0	109.3
325	N	31.4	Very low	32.6	Very low	171 Å²	171	137.6 Å²	137.6	91%	0.914	84%	0.835	S	S	*	*			trans	-79	158.5	-170	-70.8	-45.7	0	0	0	114.3
326	G	33.8	Very low	32.6	Very low	79 Å²	79	137.4 Å²	137.4	81%	0.814	83%	0.834	S	S	*	*			trans	174.9	91.1	158.1	0	0	0	0	0	112.3
327	G	29.7	Very low	32.2	Very low	72 Å²	72	138.2 Å²	138.2	74%	0.742	84%	0.838	S	S	*	*			trans	-85.1	178.3	-178.3	0	0	0	0	0	115.2
328	I	32.6	Very low	32.3	Very low	172 Å²	172	139.8 Å²	139.8	88%	0.882	84%	0.84	S	S	*	*			trans	-176.1	142.7	130.1	-88.1	154.6	0	0	0	109.9
329	H	30	Very low	32.1	Very low	189 Å²	189	138.5 Å²	138.5	88%	0.875	84%	0.836	S	S	*	*			trans	-54.3	158.8	-173.4	-77.9	-99.7	0	0	0	119.3
330	G	30.3	Very low	32.2	Very low	79 Å²	79	137.9 Å²	137.9	81%	0.814	84%	0.838	S	S	*	*			trans	-178.7	98.1	151.4	0	0	0	0	0	111.5
331	A	30	Very low	31.9	Very low	86 Å²	86	135.6 Å²	135.6	71%	0.711	83%	0.833	S	S	*	*			trans	-79.9	158.8	174.2	0	0	0	0	0	111.2
332	D	32.9	Very low	31.8	Very low	171 Å²	171	133.5 Å²	133.5	91%	0.914	83%	0.831	S	S	*	*			trans	-164.5	131.2	135.2	-86.3	-25.3	0	0	0	110.5
333	E	31.7	Very low	31.5	Very low	170 Å²	170	135.2 Å²	135.2	79%	0.794	83%	0.83	S	S	*	*			trans	-72	162.6	-177.7	-66.4	169.1	110.9	0	0	113.3
334	F	32.2	Very low	31.3	Very low	210 Å²	210	138.7 Å²	138.7	92%	0.921	83%	0.831	S	S	*	*				-174	113.8	121.1	-107.3	-77.7	0	0	0	110.4
335	S	28.3	Very low	31.1	Very low	95 Å²	95	138 Å²	138	66%	0.664	83%	0.827	S	S	*	*			trans	-91.8	157.9	170	40.4	0	0	0	0	111
336	N	31.6	Very low	30.9	Very low	166 Å²	166	134.5 Å²	134.5	89%	0.888	82%	0.816	S	S	*	*			trans	-163.8	120.1	145.5	-98.5	-16.2	0	0	0	110.5
337	E	30.7	Very low	30.8	Very low	193 Å²	193	134.7 Å²	134.7	90%	0.902	81%	0.809	S	S	*	*			trans	-114.3	149.1	164.6	-68.8	-150.5	128.8	0	0	109.4
338	E	32.5	Very low	30.7	Very low	196 Å²	196	139 Å²	139	92%	0.916	82%	0.815	S	S	*	*			trans	-167.2	116.3	150	-103.6	-174.7	124.6	0	0	105.5
339	S	31.9	Very low	30.6	Very low	107 Å²	107	134 Å²	134	75%	0.748	81%	0.806	S	S	*	*				100.3	150.3	50.5	-175.4	0	0	0	0	113.1
340	V	34.2	Very low	30.6	Very low	144 Å²	144	130.8 Å²	130.8	87%	0.873	81%	0.805	S	S	*	*			trans	90.5	121.3	171.6	-160.8	0	0	0	0	116.1
341	G	31.4	Very low	30.5	Very low	72 Å²	72	131.4 Å²	131.4	74%	0.742	80%	0.802	S	S	*	*			cis	163.3	144.7	-0.2	0	0	0	0	0	111.9
342	G	30.4	Very low	30.8	Very low	75 Å²	75	132.1 Å²	132.1	77%	0.773	80%	0.8	S	S	*	*			trans	79.8	141.4	152.2	0	0	0	0	0	119.3
343	T	30.5	Very low	30.7	Very low	138 Å²	138	131.2 Å²	131.2	85%	0.847	80%	0.795	S	S	*	*			cis	-165.6	151	7.7	-63.3	0	0	0	0	110.2
344	L	26.2	Very low	30.6	Very low	146 Å²	146	127.4 Å²	127.4	76%	0.764	79%	0.793	S	S	*	*			trans	-64.6	166.6	176.8	-65.7	149.2	0	0	0	113.8
345	I	30.1	Very low	30.6	Very low	167 Å²	167	121.9 Å²	121.9	86%	0.856	79%	0.786	S	S	*	*				-162.9	142.2	96.8	-78.1	146.7	0	0	0	110.7
346	S	27.7	Very low	30.7	Very low	98 Å²	98	121.7 Å²	121.7	69%	0.685	79%	0.79	S	S	*	*			trans	-95.9	-173.8	-172.6	-50.4	0	0	0	0	114.8
347	A	31.7	Very low	30.8	Very low	83 Å²	83	119.4 Å²	119.4	69%	0.686	78%	0.782	S	S	*	*			trans	101.1	139.6	153.9	0	0	0	0	0	115.8
348	D	29	Very low	31	Very low	162 Å²	162	115.5 Å²	115.5	87%	0.866	77%	0.771	S	S	*	*			cis	-173.6	162	-12.1	-99.3	-29.3	0	0	0	105.7
349	G	28.9	Very low	31	Very low	66 Å²	66	112.9 Å²	112.9	68%	0.68	76%	0.764	S	S	*	*			trans	114.7	90.7	144.5	0	0	0	0	0	119.3
350	S	31.6	Very low	31.2	Very low	123 Å²	123	114 Å²	114	86%	0.86	77%	0.771	S	S	*	*				76	108.9	123.6	-51.7	0	0	0	0	121.5
351	A	28.2	Very low	31	Very low	91 Å²	91	111.6 Å²	111.6	75%	0.752	77%	0.767	S	S	*	*			trans	-63.7	-171.7	153.1	0	0	0	0	0	111.4
352	P	36	Very low	31	Very low	101 Å²	101	115.1 Å²	115.1	66%	0.656	77%	0.774	S	S	*	*			cis	-152.6	-168.3	16.2	40.3	-15.4	0	0	0	117.8
353	N	30.2	Very low	30.8	Very low	153 Å²	153	117.1 Å²	117.1	82%	0.818	78%	0.776	S	S	*	*			trans	75.7	147.4	151.5	-62.2	-15.1	0	0	0	119.2
354	A	29.8	Very low	30.6	Very low	90 Å²	90	119.7 Å²	119.7	74%	0.744	78%	0.779	S	S	*	*			cis	-178.7	172.6	-11.3	0	0	0	0	0	107.9
355	A	31.3	Very low	30.7	Very low	94 Å²	94	122 Å²	122	78%	0.777	78%	0.782	S	S	*	*			trans	84	104.6	163.7	0	0	0	0	0	117
356	A	30.7	Very low	30.4	Very low	91 Å²	91	125.7 Å²	125.7	75%	0.752	79%	0.786	S	S	*	*				76	129.8	75.4	0	0	0	0	0	111
357	T	34.3	Very low	30.5	Very low	118 Å²	118	126.5 Å²	126.5	72%	0.724	79%	0.786	S	S	*	*				-169.4	142.4	59.2	42.9	0	0	0	0	112.6
358	T	34.7	Very low	30.3	Very low	110 Å²	110	127 Å²	127	68%	0.675	79%	0.785	S	S	*	*			trans	56.3	145.1	133.5	62.9	0	0	0	0	121.2
359	D	32.1	Very low	30.1	Very low	142 Å²	142	127.1 Å²	127.1	76%	0.759	79%	0.785	S	S	*	*			cis	-172.8	145.2	-5.4	-96.8	-25.9	0	0	0	106.9
360	S	37	Very low	30.1	Very low	130 Å²	130	130.5 Å²	130.5	91%	0.909	79%	0.787	S	S	*	*			trans	176.6	124.7	130.3	-79.1	0	0	0	0	111.6
361	A	28.7	Very low	30	Very low	94 Å²	94	130.1 Å²	130.1	78%	0.777	78%	0.775	S	S	*	*			trans	-90.9	151.1	-162.1	0	0	0	0	0	114.4
362	T	31.9	Very low	30.2	Very low	145 Å²	145	131.7 Å²	131.7	89%	0.89	78%	0.778	S	S	*	*				-157.2	129.8	129.9	-58.1	0	0	0	0	109.4
363	S	26.9	Very low	30.1	Very low	117 Å²	117	131.2 Å²	131.2	82%	0.818	78%	0.777	S	S	*	*			trans	-60.5	121	-158.8	-58.3	0	0	0	0	118
364	Q	26.1	Very low	30.3	Very low	193 Å²	193	130.6 Å²	130.6	90%	0.902	77%	0.769	S	S	*	*			trans	-98.2	108	156.6	-71.9	-175.6	-10.6	0	0	109.6	R366	Q364-R366 PolarHBondContact O-N 3.02Å
365	K	28.1	Very low	30.5	Very low	193 Å²	193	130.8 Å²	130.8	84%	0.839	76%	0.761	S	S	*	*			trans	-84.2	100.6	171.2	-159.1	173.3	-174.7	-180	0	108.9	V367	K365-V367 HydrophobicContact CG-CG2 4.49Å; K365-V367 PolarHBondContact O-N 3.41Å
366	R	24.4	Very low	30.6	Very low	246 Å²	246	130.3 Å²	130.3	93%	0.928	76%	0.757	S	S	*	*			trans	-53.8	126.2	161.7	-90.1	-179.9	178.9	-175.9	0.1	108.7	Q364	Q364-R366 PolarHBondContact O-N 3.02Å
367	V	28	Very low	30.5	Very low	114 Å²	114	134.1 Å²	134.1	69%	0.691	76%	0.763	S	S	*	*			trans	-127.5	128.5	160.4	-169	0	0	0	0	108.5	K365	K365-V367 HydrophobicContact CG-CG2 4.49Å; K365-V367 PolarHBondContact O-N 3.41Å
368	S	28.1	Very low	30.7	Very low	94 Å²	94	133.9 Å²	133.9	66%	0.657	75%	0.752	S	S	*	*			trans	-58.5	149.9	-173.1	36.9	0	0	0	0	114.8	L370	S368-L370 PolarHBondContact O-N 3.5Å
369	N	25.9	Very low	30.6	Very low	165 Å²	165	133.4 Å²	133.4	88%	0.882	75%	0.751	S	S	*	*			trans	-43.4	118.9	168.1	-62.9	-48.8	0	0	0	111.7
370	L	29	Very low	30.8	Very low	137 Å²	137	132 Å²	132	72%	0.717	74%	0.743	S	S	*	*			trans	-94.7	136.2	167.5	-67.5	174.5	0	0	0	109.9	S368 E374	S368-L370 PolarHBondContact O-N 3.5Å; L370-E374 WeakPolarHBondContact CD2-OE2 3.26Å
371	N	28.2	Very low	30.9	Very low	114 Å²	114	128.5 Å²	128.5	61%	0.61	72%	0.718	S	S	*	*			trans	-71.9	142.3	-171	-149.2	-11.8	0	0	0	109.9	S373 E374	N371-S373 PolarHBondContact O-N 3.1Å; N371-E374 PolarHBondContact O-N 2.78Å
372	P	32.2	Very low	31.3	Very low	124 Å²	124	131.5 Å²	131.5	81%	0.805	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	4.2	178.5	-23.3	34.4	0	0	0	116.1
373	S	35.4	Very low	31.4	Very low	91 Å²	91	128.8 Å²	128.8	64%	0.636	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-10.7	177.4	53.5	0	0	0	0	114.3	N371 V375	N371-S373 PolarHBondContact O-N 3.1Å; S373-V375 VanDerWaalsContact C-N 3.26Å; S373-V375 PolarHBondContact O-N 2.58Å
374	E	32.5	Very low	31.7	Very low	140 Å²	140	128.5 Å²	128.5	65%	0.654	70%	0.704	S	S	*	*			trans	-91.3	57.5	171.5	-79.5	-178.9	150.3	0	0	110.8	L370 N371 A376	L370-E374 WeakPolarHBondContact CD2-OE2 3.26Å; N371-E374 PolarHBondContact O-N 2.78Å; E374-A376 PolarHBondContact O-N 3.11Å
375	V	35	Very low	32	Very low	94 Å²	94	122.7 Å²	122.7	57%	0.57	68%	0.683	S	S	*	*			trans	-81	112.4	160.9	179.1	0	0	0	0	105.4	S373 I377	S373-V375 VanDerWaalsContact C-N 3.26Å; S373-V375 PolarHBondContact O-N 2.58Å; V375-I377 PolarHBondContact O-N 3.25Å; V375-I377 VanDerWaalsContact O-N 3.1Å
376	A	33.3	Very low	32.1	Very low	84 Å²	84	118.9 Å²	118.9	69%	0.694	68%	0.678	S	S	*	*			trans	-41	119.7	179.1	0	0	0	0	0	110.6	E374 F378	E374-A376 PolarHBondContact O-N 3.11Å; A376-F378 PolarHBondContact O-N 3.23Å
377	I	29.1	Very low	32.5	Very low	171 Å²	171	113.1 Å²	113.1	88%	0.877	67%	0.669	S	S	*	*			trans	-61.1	108.9	-179.7	-63.4	168.3	0	0	0	107	V375	V375-I377 PolarHBondContact O-N 3.25Å; V375-I377 VanDerWaalsContact O-N 3.1Å
378	F	37.1	Very low	32.8	Very low	113 Å²	113	115 Å²	115	50%	0.496	67%	0.674	S	S	.	*			trans	-61.1	141.7	173	-71.1	-88	0	0	0	110	A376	A376-F378 PolarHBondContact O-N 3.23Å
379	P	33.9	Very low	32.9	Very low	100 Å²	100	119 Å²	119	65%	0.649	68%	0.683	S	S	*	*			trans	-60	149.3	167.9	-9.5	23.8	0	0	0	109.7	C381	P379-C381 PolarHBondContact O-N 3.3Å; P379-C381 VanDerWaalsContact O-N 3.11Å
380	D	35.7	Very low	33.1	Very low	112 Å²	112	116.6 Å²	116.6	60%	0.599	68%	0.676	S	S	*	*			trans	-54.8	115.9	-174.8	-79.4	-43	0	0	0	113.5	K200 D382	K200-D380 IonicContact NZ-OD1 2.75Å; K200-D380 PolarHBondContact NZ-OD1 2.86Å; D380-D382 PolarHBondContact O-N 3.44Å
381	C	38.7	Very low	33	Very low	58 Å²	58	117.9 Å²	117.9	39%	0.392	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.1	8.5	-175.2	-9.7	0	0	0	0	113.1	C199 P379 S383	C199-C381 VanDerWaalsContact SG-CB 3.57Å; P379-C381 PolarHBondContact O-N 3.3Å; P379-C381 VanDerWaalsContact O-N 3.11Å; C381-S383 PolarHBondContact O-N 3.45Å
382	D	37.4	Very low	33	Very low	157 Å²	157	119 Å²	119	84%	0.84	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-10.5	172.2	-71.1	-38.5	0	0	0	111.9	D380	D380-D382 PolarHBondContact O-N 3.44Å
383	S	35.1	Very low	32.6	Very low	88 Å²	88	118.4 Å²	118.4	62%	0.615	68%	0.683	S	S	*	*	S	Bend	trans	-85.6	132	171.4	-61.9	0	0	0	0	110.9	C381	C381-S383 PolarHBondContact O-N 3.45Å
384	P	32.8	Very low	32.3	Very low	111 Å²	111	123.2 Å²	123.2	72%	0.721	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-58	143.9	168.3	26.1	-32.2	0	0	0	109.4
385	P	31.5	Very low	32.1	Very low	71 Å²	71	127.2 Å²	127.2	46%	0.461	70%	0.704	S	S	.	*	P	Polyproline II helix	trans	-58.5	147.1	178	25.5	-34.1	0	0	0	110.3	Y190 V387	Y190-P385 HydrophobicContact CE1-CG 4.01Å; P385-V387 PolarHBondContact O-N 2.97Å
386	P	31.2	Very low	31.8	Very low	113 Å²	113	129.5 Å²	129.5	73%	0.734	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-57.7	133.9	177.2	23.6	-31.9	0	0	0	110	L388	P386-L388 PolarHBondContact O-N 3.01Å; P386-L388 VanDerWaalsContact O-N 3.14Å
387	V	32.6	Very low	31.7	Very low	125 Å²	125	133.7 Å²	133.7	76%	0.758	72%	0.724	S	S	*	*			trans	-64.8	112.2	174.5	178.9	0	0	0	0	107.7	P385 E389	P385-V387 PolarHBondContact O-N 2.97Å; V387-E389 PolarHBondContact O-N 3.2Å
388	L	33.5	Very low	31.6	Very low	152 Å²	152	132.1 Å²	132.1	80%	0.796	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-65.8	123.6	172.5	-68.1	173.9	0	0	0	109.2	P386	P386-L388 PolarHBondContact O-N 3.01Å; P386-L388 VanDerWaalsContact O-N 3.14Å
389	E	30	Very low	31.5	Very low	179 Å²	179	132.1 Å²	132.1	84%	0.836	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-68.6	144.3	173.2	-69.3	-156.4	148.9	0	0	110.8	V387 I391	V387-E389 PolarHBondContact O-N 3.2Å; E389-I391 PolarHBondContact O-N 3.03Å
390	P	31.4	Very low	31.1	Very low	114 Å²	114	135.1 Å²	135.1	74%	0.74	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-70.2	128.7	-179.6	-5.1	20.5	0	0	0	110.5	I392	P390-I392 PolarHBondContact O-N 3.08Å
391	I	26.1	Very low	30.9	Very low	164 Å²	164	140.6 Å²	140.6	84%	0.841	76%	0.759	S	S	*	*			trans	-65	105.9	161.4	-60	173.2	0	0	0	106.9	E389 P393	E389-I391 PolarHBondContact O-N 3.03Å; I391-P393 WeakPolarHBondContact O-CD 3.35Å
392	I	27.9	Very low	30.4	Very low	137 Å²	137	147.8 Å²	147.8	70%	0.703	78%	0.783	S	S	*	*			trans	-68.1	121.3	175.8	-58.8	174.1	0	0	0	108.1	P390 Q394	P390-I392 PolarHBondContact O-N 3.08Å; I392-Q394 PolarHBondContact O-N 2.83Å; I392-Q394 VanDerWaalsContact O-N 3.09Å
393	P	24.9	Very low	29.9	Very low	113 Å²	113	150.4 Å²	150.4	73%	0.734	78%	0.782	S	S	*	*			trans	-69.4	108.5	171	-11.4	26.8	0	0	0	108.6	I391 R395	I391-P393 WeakPolarHBondContact O-CD 3.35Å; P393-R395 PolarHBondContact O-N 3.48Å
394	Q	29.2	Very low	29.4	Very low	191 Å²	191	152.5 Å²	152.5	89%	0.893	79%	0.791	S	S	*	*			trans	-69.6	101.9	167.8	-72.9	-161	-60	0	0	108.7	I392	I392-Q394 PolarHBondContact O-N 2.83Å; I392-Q394 VanDerWaalsContact O-N 3.09Å
395	R	28.9	Very low	29.3	Very low	224 Å²	224	153.4 Å²	153.4	85%	0.845	79%	0.794	S	S	*	*			trans	-78.1	122.8	160.9	-83	-178.8	168	136.2	-2.7	109.1	P393	P393-R395 PolarHBondContact O-N 3.48Å
396	D	26.9	Very low	29.1	Very low	143 Å²	143	155.6 Å²	155.6	77%	0.765	81%	0.811	S	S	*	*			trans	50.7	87.8	150.2	-51.1	-38.4	0	0	0	118.1
397	L	31.4	Very low	28.9	Very low	172 Å²	172	161 Å²	161	90%	0.901	82%	0.819	S	S	*	*			trans	-130.3	94.9	148.8	-84	165.5	0	0	0	109.1	S399	L397-S399 PolarHBondContact O-N 3.2Å
398	T	27	Very low	28.6	Very low	137 Å²	137	162.6 Å²	162.6	84%	0.84	82%	0.823	S	S	*	*			trans	-61.9	118.6	166.6	52.1	0	0	0	0	110.1
399	S	34.6	Very low	28.3	Very low	114 Å²	114	166.1 Å²	166.1	80%	0.797	83%	0.826	S	S	*	*			trans	-179.3	116.9	145.6	172.8	0	0	0	0	110.6	L397 R401	L397-S399 PolarHBondContact O-N 3.2Å; S399-R401 PolarHBondContact O-N 2.95Å
400	N	27	Very low	28.1	Very low	163 Å²	163	162.2 Å²	162.2	87%	0.872	82%	0.818	S	S	*	*			trans	-38.2	119.8	163.4	-86.9	-44.2	0	0	0	113.4
401	R	31.6	Very low	28.1	Very low	227 Å²	227	165 Å²	165	86%	0.857	82%	0.822	S	S	*	*			trans	-159.5	113.4	135.8	-131.6	172.1	179.6	179.5	0.3	112.1	S399 R403	S399-R401 PolarHBondContact O-N 2.95Å; R401-R403 PolarHBondContact O-N 2.87Å
402	K	26.8	Very low	28.3	Very low	208 Å²	208	165.8 Å²	165.8	90%	0.904	82%	0.822	S	S	*	*			trans	-45.4	120.6	161.7	-71.4	173.4	174.6	177.7	0	110
403	R	28	Very low	28.3	Very low	212 Å²	212	163.9 Å²	163.9	80%	0.8	82%	0.82	S	S	*	*			trans	-152.2	115.9	147.5	-145.4	175.6	-81.4	-171.3	-4.9	110.1	R401	R401-R403 PolarHBondContact O-N 2.87Å
404	T	24.9	Very low	28.7	Very low	132 Å²	132	166.4 Å²	166.4	81%	0.81	82%	0.82	S	S	*	*			trans	-66	120.6	170.2	47.5	0	0	0	0	109.8
405	T	29.9	Very low	28.9	Very low	130 Å²	130	164.7 Å²	164.7	80%	0.798	82%	0.817	S	S	*	*			trans	-150.4	112.7	153	47.9	0	0	0	0	108
406	S	26.5	Very low	29	Very low	117 Å²	117	165.1 Å²	165.1	82%	0.818	82%	0.819	S	S	*	*			trans	-54.3	130.3	166.1	48.5	0	0	0	0	110.7
407	Y	27.8	Very low	29.2	Very low	228 Å²	228	163.2 Å²	163.2	89%	0.894	80%	0.804	S	S	*	*			trans	-140.6	112.2	155.2	-137.8	-95.8	0	0	0	108.1	R409	Y407-R409 PolarHBondContact O-N 2.84Å
408	D	26	Very low	29.1	Very low	157 Å²	157	158.2 Å²	158.2	84%	0.84	79%	0.787	S	S	*	*			trans	-51	125	178.9	-99.8	-47.7	0	0	0	111.3
409	R	27	Very low	29.6	Very low	227 Å²	227	154.5 Å²	154.5	86%	0.857	77%	0.765	S	S	*	*			trans	-102.8	98.4	158.6	-113.8	-174.2	164.9	136.4	-1.5	106	Y407 E411	Y407-R409 PolarHBondContact O-N 2.84Å; R409-E411 PolarHBondContact O-N 3.16Å
410	S	26.8	Very low	29.5	Very low	97 Å²	97	155 Å²	155	68%	0.678	75%	0.753	S	S	*	*			trans	-67.2	100.4	168	45.4	0	0	0	0	108.9	E412	S410-E412 PolarHBondContact O-N 2.94Å; S410-E412 VanDerWaalsContact O-N 3.1Å
411	E	32	Very low	29.8	Very low	173 Å²	173	151 Å²	151	81%	0.808	74%	0.735	S	S	*	*			trans	-73.7	23.2	170.8	-69.5	-170.1	145.9	0	0	112.7	R409 S413	R409-E411 PolarHBondContact O-N 3.16Å; E411-S413 PolarHBondContact O-N 2.74Å
412	E	28.8	Very low	30.2	Very low	180 Å²	180	140.4 Å²	140.4	84%	0.841	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	11.6	-166.4	-68.5	-166	144.6	0	0	115.8	S410	S410-E412 PolarHBondContact O-N 2.94Å; S410-E412 VanDerWaalsContact O-N 3.1Å
413	S	29	Very low	30.4	Very low	97 Å²	97	138 Å²	138	68%	0.678	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	-2.9	-175.2	64.7	0	0	0	0	117.1	E411	E411-S413 PolarHBondContact O-N 2.74Å
414	F	32.6	Very low	30.8	Very low	166 Å²	166	131 Å²	131	73%	0.728	65%	0.654	S	S	*	*	S	Bend	trans	-104.4	-9.3	-171.3	-125.5	-97.7	0	0	0	116.2
415	D	33.3	Very low	31.1	Very low	154 Å²	154	130.7 Å²	130.7	82%	0.824	65%	0.651	S	S	*	*			trans	-94	7	-173.8	-90.4	-23.7	0	0	0	116.2	F417	D415-F417 PolarHBondContact O-N 3.04Å
416	R	31.6	Very low	31.2	Very low	234 Å²	234	128.9 Å²	128.9	88%	0.883	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	4.6	179.4	-77	-175.1	178.4	169.4	1.9	115.1
417	F	30.2	Very low	31.5	Very low	102 Å²	102	133.6 Å²	133.6	45%	0.447	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.7	11	-171.7	-63.8	-74.4	0	0	0	115.1	D415	D415-F417 PolarHBondContact O-N 3.04Å
418	A	30.5	Very low	31.6	Very low	67 Å²	67	129.4 Å²	129.4	55%	0.554	64%	0.643	S	S	*	*			trans	-72.6	126.4	175.2	0	0	0	0	0	111.9	F420	A418-F420 PolarHBondContact O-N 3.24Å
419	P	36	Very low	31.8	Very low	59 Å²	59	125.9 Å²	125.9	38%	0.383	64%	0.636	S	S	.	*			trans	-74.2	95.2	167.8	28.8	-28	0	0	0	109.4	T215	T215-P419 WeakPolarHBondContact OG1-CD 3.34Å; T215-P419 WeakPolarHBondContact OG1-CG 3.49Å
420	F	32.7	Very low	31.7	Very low	125 Å²	125	127 Å²	127	55%	0.548	64%	0.64	S	S	.	*			trans	57.4	117.5	147.2	-4.1	-79.4	0	0	0	118.9	F121 A418 V422	F121-F420 HydrophobicContact CB-CE2 4.46Å; A418-F420 PolarHBondContact O-N 3.24Å; F420-V422 PolarHBondContact O-N 3.44Å
421	V	33.7	Very low	31.9	Very low	79 Å²	79	128 Å²	128	48%	0.479	65%	0.647	S	S	.	*			trans	-51.7	123.3	160.6	-174.8	0	0	0	0	110.5	R423	V421-R423 HydrophobicContact CG1-CG 3.75Å; V421-R423 PolarHBondContact O-N 3.42Å
422	V	39.3	Very low	31.9	Very low	5 Å²	5	127.3 Å²	127.3	3%	0.03	65%	0.649	C	S	.	*			trans	-75.3	90.4	171.1	-174.7	0	0	0	0	109.1	Q59 Y124 F420	Q59-V422 HydrophobicContact CB-CB 4.46Å; Y124-V422 HydrophobicContact CD2-CG1 4.22Å; Y124-V422 HydrophobicContact CD2-CG2 3.47Å; Y124-V422 VanDerWaalsContact CD2-CG2 3.47Å; Y124-V422 HydrophobicContact CE2-CG2 3.22Å; Y124-V422 HydrophobicContact CG-CG2 4.49Å; F420-V422 PolarHBondContact O-N 3.44Å
423	R	30.7	Very low	31.9	Very low	156 Å²	156	123 Å²	123	59%	0.589	64%	0.644	S	S	*	*			trans	-98.6	103.1	166.3	-69.6	-171.3	179.3	166.8	1.9	109.8	V421 V425	V421-R423 HydrophobicContact CG1-CG 3.75Å; V421-R423 PolarHBondContact O-N 3.42Å; R423-V425 PolarHBondContact O-N 2.88Å
424	R	37.5	Very low	32.1	Very low	67 Å²	67	128.5 Å²	128.5	25%	0.253	66%	0.656	S	S	.	*			trans	-75	111.6	160.4	-74	-166	-168.6	127.6	-2.3	108.5	S54 E55 L57	S54-R424 PolarHBondContact O-NH1 3.44Å; S54-R424 PolarHBondContact O-NH2 2.97Å; E55-R424 VanDerWaalsContact C-NH1 3.32Å; L57-R424 PolarHBondContact O-NH1 2.92Å
425	V	30.5	Very low	32.2	Very low	124 Å²	124	126.4 Å²	126.4	75%	0.752	66%	0.657	S	S	*	*			trans	-79.3	118.5	161.7	-177.5	0	0	0	0	106.5	R423 K427	R423-V425 PolarHBondContact O-N 2.88Å; V425-K427 PolarHBondContact O-N 3.46Å
426	S	32.2	Very low	32.2	Very low	93 Å²	93	124.8 Å²	124.8	65%	0.65	66%	0.655	S	S	*	*			trans	-54.5	129.6	166.7	-72.1	0	0	0	0	108.6	D428	S426-D428 PolarHBondContact O-N 3.16Å
427	K	34	Very low	32.3	Very low	215 Å²	215	119 Å²	119	94%	0.935	65%	0.645	S	S	*	*			trans	-66.7	91.5	163.8	-107.8	179.4	177.1	172.5	0	107.3	V425	V425-K427 PolarHBondContact O-N 3.46Å
428	D	29.6	Very low	32.4	Very low	141 Å²	141	122 Å²	122	75%	0.754	67%	0.665	S	S	*	*			trans	-62.4	135.8	164.6	-74.5	-31.8	0	0	0	109.7	S426	S426-D428 PolarHBondContact O-N 3.16Å
429	A	28.7	Very low	32.5	Very low	83 Å²	83	125 Å²	125	69%	0.686	67%	0.672	S	S	*	*			trans	49	94.6	135.8	0	0	0	0	0	117.3
430	R	26.9	Very low	32.4	Very low	251 Å²	251	127.1 Å²	127.1	95%	0.947	69%	0.689	S	S	*	*			trans	-134	78.7	145.8	-83.2	-169.9	170.9	179.6	-3	109.7
431	S	30.1	Very low	32.5	Very low	116 Å²	116	128.7 Å²	128.7	81%	0.811	70%	0.703	S	S	*	*			trans	-167.1	80.7	148.5	58.6	0	0	0	0	108.3
432	D	30.8	Very low	32.5	Very low	160 Å²	160	133.7 Å²	133.7	86%	0.856	72%	0.721	S	S	*	*			trans	-74.9	129.4	168.8	-79.7	-40.1	0	0	0	110.8
433	A	29.9	Very low	32.4	Very low	90 Å²	90	137.8 Å²	137.8	74%	0.744	75%	0.748	S	S	*	*			trans	67.3	107.1	141	0	0	0	0	0	120.8
434	K	33.2	Very low	32.5	Very low	212 Å²	212	136.3 Å²	136.3	92%	0.922	76%	0.756	S	S	*	*				-141.4	108	129.6	-106.6	-179.6	-177.6	178.7	0	109.7
435	T	34.6	Very low	32.2	Very low	122 Å²	122	139.2 Å²	139.2	75%	0.748	78%	0.782	S	S	*	*			trans	-132.8	151.7	155.7	-16.1	0	0	0	0	106.1
436	P	34.4	Very low	32.4	Very low	120 Å²	120	138.4 Å²	138.4	78%	0.779	78%	0.781	S	S	*	*				-141.7	139.7	80.6	22.1	1.5	0	0	0	113.8
437	V	31.9	Very low	32.3	Very low	111 Å²	111	139.8 Å²	139.8	67%	0.673	79%	0.786	S	S	*	*				61	116.6	95.8	-172.8	0	0	0	0	114.5
438	N	33.8	Very low	32.3	Very low	165 Å²	165	136.2 Å²	136.2	88%	0.882	78%	0.777	S	S	*	*			trans	-137.6	134.2	139.5	-144.5	-0.4	0	0	0	110.5
439	N	31.9	Very low	32.5	Very low	131 Å²	131	136.4 Å²	136.4	70%	0.701	78%	0.778	S	S	*	*			trans	-67.8	154.4	-175.4	-82.8	-30.7	0	0	0	112.8
440	S	33.9	Very low	32.5	Very low	103 Å²	103	141.4 Å²	141.4	72%	0.72	79%	0.785	S	S	*	*				166.1	133.6	109	-66.8	0	0	0	0	112.9
441	N	34.6	Very low	32.8	Very low	159 Å²	159	136.9 Å²	136.9	85%	0.85	78%	0.78	S	S	*	*			trans	93.7	89.8	149.7	-58	-13.7	0	0	0	121.6
442	Q	34.5	Very low	32.9	Very low	183 Å²	183	135.5 Å²	135.5	86%	0.855	77%	0.768	S	S	*	*			trans	-29.2	179.3	135.5	-99.8	-164.3	-15.7	0	0	118.1
443	P	36.6	Very low	32.8	Very low	92 Å²	92	135.2 Å²	135.2	60%	0.597	77%	0.766	S	S	*	*				-143	-172.3	-51.2	38.9	-17.6	0	0	0	112.6
444	T	33.6	Very low	32.9	Very low	125 Å²	125	140.4 Å²	140.4	77%	0.767	78%	0.775	S	S	*	*			trans	159.1	104.9	141.4	39.6	0	0	0	0	110.7
445	T	30	Very low	32.6	Very low	128 Å²	128	140.8 Å²	140.8	79%	0.785	78%	0.777	S	S	*	*				81.3	114.5	87.7	57.1	0	0	0	0	116.9
446	S	34.9	Very low	32.3	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	78%	0.781	S	S	*	*				163.5	97.8	127.2	63.6	0	0	0	0	108.8
447	T	29.7	Very low	31.7	Very low	122 Å²	122	142.4 Å²	142.4	75%	0.748	79%	0.785	S	S	*	*				57.6	126.6	82.4	64.7	0	0	0	0	116.3
448	N	35.2	Very low	31.4	Very low	139 Å²	139	142.4 Å²	142.4	74%	0.743	79%	0.785	S	S	*	*			trans	139.5	136.4	146	-68.7	5.3	0	0	0	109.2
449	D	33.5	Very low	31.1	Very low	146 Å²	146	142.9 Å²	142.9	78%	0.781	78%	0.782	S	S	*	*			cis	-169.3	159.8	-23.5	-102.4	-37.5	0	0	0	105.7
450	F	28	Very low	30.6	Very low	187 Å²	187	143.3 Å²	143.3	82%	0.82	78%	0.784	S	S	*	*			trans	-63.4	154.4	179.3	-96.3	-113.7	0	0	0	114.6
451	D	33	Very low	30.2	Very low	157 Å²	157	146.2 Å²	146.2	84%	0.84	79%	0.789	S	S	*	*				-170.1	145.9	108.5	-106.8	-28.4	0	0	0	114.2
452	P	33.5	Very low	29.7	Very low	86 Å²	86	147 Å²	147	56%	0.558	79%	0.785	S	S	*	*			trans	-104.5	-174.6	178.5	40.4	-28.9	0	0	0	113.4
453	D	28.6	Very low	29.4	Very low	154 Å²	154	142 Å²	142	82%	0.824	78%	0.784	S	S	*	*			trans	84.7	112.2	170.2	-58.2	-24.6	0	0	0	118.8
454	E	32.4	Very low	29	Very low	200 Å²	200	143.1 Å²	143.1	94%	0.935	79%	0.794	S	S	*	*				-164.4	118.7	123.3	-130.7	179.4	169.4	0	0	112.8
455	F	26.4	Very low	29	Very low	219 Å²	219	142.1 Å²	142.1	96%	0.961	79%	0.789	S	S	*	*			trans	-75.7	141.3	162.7	-96.5	-104	0	0	0	109.8
456	G	28.5	Very low	29	Very low	80 Å²	80	143.5 Å²	143.5	83%	0.825	79%	0.792	S	S	*	*			trans	-155.3	108.4	170.7	0	0	0	0	0	112.2
457	F	21.9	Very low	28.8	Very low	197 Å²	197	143.5 Å²	143.5	86%	0.864	79%	0.792	S	S	*	*			trans	-85.4	172.1	-176.1	-163.8	-101	0	0	0	112
458	T	24.5	Very low	28.9	Very low	111 Å²	111	146.7 Å²	146.7	68%	0.681	80%	0.795	S	S	*	*			trans	80.8	137.1	163.7	5.6	0	0	0	0	116.4
459	E	27.3	Very low	28.6	Very low	174 Å²	174	150.3 Å²	150.3	81%	0.813	80%	0.8	S	S	*	*			cis	-149.2	151.7	23	-95.7	-174.2	148.2	0	0	113
460	L	22.4	Very low	28.6	Very low	141 Å²	141	151 Å²	151	74%	0.738	80%	0.804	S	S	*	*			trans	-75	142.2	164.6	-70	155	0	0	0	110.7	F462	L460-F462 HydrophobicContact CB-CD2 4.5Å; L460-F462 HydrophobicContact CD1-CE2 4.37Å; L460-F462 HydrophobicContact CD2-CE2 4.29Å
461	I	26.1	Very low	28.8	Very low	164 Å²	164	150.6 Å²	150.6	84%	0.841	80%	0.804	S	S	*	*			trans	-127.2	109.2	151.9	-61.6	-174.3	0	0	0	109.1
462	F	23.4	Very low	29	Very low	174 Å²	174	151.1 Å²	151.1	76%	0.763	81%	0.807	S	S	*	*			trans	-74.2	142.4	163	-82	-94.8	0	0	0	110.2	L460	L460-F462 HydrophobicContact CB-CD2 4.5Å; L460-F462 HydrophobicContact CD1-CE2 4.37Å; L460-F462 HydrophobicContact CD2-CE2 4.29Å
463	G	28.1	Very low	28.9	Very low	80 Å²	80	152.2 Å²	152.2	83%	0.825	82%	0.823	S	S	*	*			trans	-138.3	100.9	165.2	0	0	0	0	0	109.9
464	S	27.7	Very low	29.1	Very low	115 Å²	115	148.5 Å²	148.5	80%	0.804	82%	0.822	S	S	*	*			trans	-74.3	167.5	-177.2	-102.5	0	0	0	0	114.7
465	P	34.5	Very low	28.9	Very low	104 Å²	104	145.1 Å²	145.1	68%	0.675	82%	0.82	S	S	*	*			trans	-92	163.4	-174	38.3	-33	0	0	0	112.9
466	D	28.6	Very low	29.3	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	82%	0.815	S	S	*	*			trans	178.9	151.2	143.2	-95.5	-26.7	0	0	0	115.6
467	S	30.8	Very low	29.3	Very low	107 Å²	107	141.7 Å²	141.7	75%	0.748	82%	0.817	S	S	*	*			trans	82.2	136.5	160.1	81.8	0	0	0	0	117.5
468	K	33.3	Very low	29.8	Very low	189 Å²	189	137.8 Å²	137.8	82%	0.822	81%	0.814	S	S	*	*			cis	-162.7	146.4	14	-126	163	-173.2	-178.9	0	109.1
469	Y	27.8	Very low	30	Very low	214 Å²	214	138 Å²	138	84%	0.839	82%	0.82	S	S	*	*			trans	-68.9	143.2	166.5	-69	-99.8	0	0	0	110.2
470	D	34.3	Very low	30.3	Very low	162 Å²	162	134.8 Å²	134.8	87%	0.866	82%	0.817	S	S	*	*			trans	-143.4	110.4	147.8	-83.2	-45.2	0	0	0	107.7
471	E	31.8	Very low	30.7	Very low	178 Å²	178	134.4 Å²	134.4	83%	0.832	83%	0.826	S	S	*	*			trans	-85.6	131.5	163.7	-69	-165.5	142.9	0	0	108
472	D	36.7	Very low	31	Very low	168 Å²	168	135.9 Å²	135.9	90%	0.898	83%	0.826	S	S	*	*			trans	-135.6	110.4	156.6	-91.3	-37.1	0	0	0	109.5
473	A	31.2	Very low	31.3	Very low	108 Å²	108	139.2 Å²	139.2	89%	0.893	83%	0.834	S	S	*	*			trans	-76.4	133.5	170.1	0	0	0	0	0	110.1
474	G	33.3	Very low	31.6	Very low	77 Å²	77	141.9 Å²	141.9	79%	0.794	83%	0.834	S	S	*	*			trans	-160.8	77.3	177.6	0	0	0	0	0	112.2
475	S	29.4	Very low	32	Very low	128 Å²	128	142.4 Å²	142.4	90%	0.895	83%	0.833	S	S	*	*			trans	-52.4	130.1	169.9	-66.2	0	0	0	0	112.7
476	S	34.5	Very low	32.6	Very low	123 Å²	123	141.8 Å²	141.8	86%	0.86	82%	0.823	S	S	*	*			trans	-162.7	125.8	135.1	47.7	0	0	0	0	111.1
477	A	28	Very low	33.8	Very low	105 Å²	105	136.5 Å²	136.5	87%	0.868	80%	0.798	S	S	*	*			trans	-72.1	138.8	177	0	0	0	0	0	111.2
478	S	32.8	Very low	34.9	Very low	114 Å²	114	135.6 Å²	135.6	80%	0.797	79%	0.79	S	S	*	*			trans	-154.4	123.4	141.5	54.4	0	0	0	0	110.9
479	S	29.1	Very low	35.8	Very low	116 Å²	116	133.5 Å²	133.5	81%	0.811	78%	0.781	S	S	*	*			trans	-61.8	132.9	176.6	50.6	0	0	0	0	112.1
480	S	33.3	Very low	36.8	Very low	106 Å²	106	128.2 Å²	128.2	74%	0.741	76%	0.764	S	S	*	*			trans	-151.8	104.4	160	-66.7	0	0	0	0	109.6	K482	S480-K482 PolarHBondContact O-N 3.21Å
481	S	29.3	Very low	37.6	Very low	133 Å²	133	124.7 Å²	124.7	93%	0.93	74%	0.743	S	S	*	*			trans	-46.2	115.1	176.1	-67.8	0	0	0	0	112.9
482	K	34	Very low	38.7	Very low	195 Å²	195	118.6 Å²	118.6	85%	0.848	72%	0.72	S	S	*	*			trans	-115.6	106.4	163	-77.7	-179.4	-179.2	171.9	0	109.3	S480 T484	S480-K482 PolarHBondContact O-N 3.21Å; K482-T484 PolarHBondContact O-N 3.01Å; K482-T484 VanDerWaalsContact O-N 3.16Å
483	R	28.3	Very low	39.7	Very low	244 Å²	244	114.1 Å²	114.1	92%	0.921	70%	0.695	S	S	*	*			trans	-59.1	105.2	171.9	-165.7	-178.2	-137	-171.3	3.7	108.9	T485	R483-T485 PolarHBondContact O-N 3.09Å
484	T	34.4	Very low	40.8	Very low	136 Å²	136	112.6 Å²	112.6	83%	0.834	67%	0.672	S	S	*	*			trans	-75.6	106.9	175.3	14.2	0	0	0	0	109.8	K482 I486	K482-T484 PolarHBondContact O-N 3.01Å; K482-T484 VanDerWaalsContact O-N 3.16Å; T484-I486 PolarHBondContact O-N 3.09Å
485	T	36.9	Very low	42.2	Very low	126 Å²	126	114 Å²	114	77%	0.773	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-73.6	116.1	167.9	47.1	0	0	0	0	109.4	R483	R483-T485 PolarHBondContact O-N 3.09Å
486	I	46.8	Very low	43.6	Very low	92 Å²	92	111.4 Å²	111.4	47%	0.472	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-62.4	131.3	174.2	-61.3	176	0	0	0	108.9	T484 Q490 M491 L494	T484-I486 PolarHBondContact O-N 3.09Å; I486-Q490 HydrophobicContact CG2-CB 3.42Å; I486-Q490 VanDerWaalsContact CG2-CB 3.42Å; I486-M491 HydrophobicContact CB-CG 4.46Å; I486-M491 HydrophobicContact CB-SD 4.29Å; I486-M491 HydrophobicContact CD1-SD 4.41Å; I486-M491 HydrophobicContact CG2-CG 3.8Å; I486-M491 HydrophobicContact CG2-SD 3.8Å; I486-L494 HydrophobicContact CD1-CD1 4.37Å
487	S	54.4	Low	44.5	Very low	45 Å²	45	109.7 Å²	109.7	32%	0.315	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-69.3	152.5	177.9	74	0	0	0	0	111.3	F489 Q490 M491	S487-F489 PolarHBondContact O-N 2.89Å; S487-F489 VanDerWaalsContact O-N 3.08Å; S487-Q490 PolarHBondContact O-N 3.24Å; S487-Q490 WeakPolarHBondContact OG-CG 3.32Å; S487-Q490 PolarHBondContact OG-N 3.49Å; S487-M491 PolarHBondContact O-N 3.43Å
488	P	53	Low	45.9	Very low	89 Å²	89	111.4 Å²	111.4	58%	0.578	61%	0.607	S	S	*	*	H	α-helix	trans	-54.4	-29	174.3	-26.6	34.6	0	0	0	113.9	S492	P488-S492 PolarHBondContact O-N 3.33Å
489	F	51.6	Low	47.2	Very low	144 Å²	144	112.6 Å²	112.6	63%	0.632	60%	0.598	S	S	*	*	H	α-helix	trans	-69	-46	175.2	-176.9	-109.4	0	0	0	111.9	S487 M491 S492 I493	S487-F489 PolarHBondContact O-N 2.89Å; S487-F489 VanDerWaalsContact O-N 3.08Å; F489-M491 VanDerWaalsContact C-N 3.3Å; F489-M491 PolarHBondContact O-N 3.5Å; F489-S492 PolarHBondContact O-N 3.39Å; F489-S492 VanDerWaalsContact O-N 3.12Å; F489-S492 PolarHBondContact O-OG 3.36Å; F489-I493 HydrophobicContact CD1-CD1 3.87Å; F489-I493 HydrophobicContact CE1-CD1 3.43Å; F489-I493 VanDerWaalsContact CE1-CD1 3.43Å; F489-I493 HydrophobicContact CE1-CG1 4.43Å; F489-I493 HydrophobicContact CZ-CD1 3.83Å; F489-I493 HydrophobicContact CZ-CG1 4.49Å; F489-I493 PolarHBondContact O-N 3.25Å
490	Q	48.7	Very low	48.5	Very low	104 Å²	104	111.1 Å²	111.1	49%	0.486	58%	0.577	S	S	.	*	H	α-helix	trans	-62.9	-36.3	174.3	-75.2	174	-37.2	0	0	111.8	I486 S487 I493 L494	I486-Q490 HydrophobicContact CG2-CB 3.42Å; I486-Q490 VanDerWaalsContact CG2-CB 3.42Å; S487-Q490 PolarHBondContact O-N 3.24Å; S487-Q490 WeakPolarHBondContact OG-CG 3.32Å; S487-Q490 PolarHBondContact OG-N 3.49Å; Q490-I493 PolarHBondContact O-N 3.15Å; Q490-L494 WeakPolarHBondContact O-CG 3.32Å; Q490-L494 PolarHBondContact O-N 3.04Å
491	M	52.5	Low	49.4	Very low	88 Å²	88	112.7 Å²	112.7	43%	0.433	57%	0.571	S	S	.	*	H	α-helix	trans	-62.6	-41.3	171.3	-72.3	-59.1	-61.3	0	0	112.2	I486 S487 F489 I493 L494 E495	I486-M491 HydrophobicContact CB-CG 4.46Å; I486-M491 HydrophobicContact CB-SD 4.29Å; I486-M491 HydrophobicContact CD1-SD 4.41Å; I486-M491 HydrophobicContact CG2-CG 3.8Å; I486-M491 HydrophobicContact CG2-SD 3.8Å; S487-M491 PolarHBondContact O-N 3.43Å; F489-M491 VanDerWaalsContact C-N 3.3Å; F489-M491 PolarHBondContact O-N 3.5Å; M491-I493 VanDerWaalsContact C-N 3.32Å; M491-I493 PolarHBondContact O-N 3.11Å; M491-L494 PolarHBondContact O-N 3.26Å; M491-L494 HydrophobicContact SD-CD1 4.5Å; M491-E495 PolarHBondContact O-N 3.26Å
492	S	55.2	Low	50.3	Low	49 Å²	49	108.9 Å²	108.9	34%	0.343	54%	0.544	S	S	.	.	H	α-helix	trans	-67.5	-32.5	177.8	85.5	0	0	0	0	113	P488 F489 T496	P488-S492 PolarHBondContact O-N 3.33Å; F489-S492 PolarHBondContact O-N 3.39Å; F489-S492 VanDerWaalsContact O-N 3.12Å; F489-S492 PolarHBondContact O-OG 3.36Å; S492-T496 WeakPolarHBondContact O-CB 3.34Å; S492-T496 PolarHBondContact O-N 3.11Å; S492-T496 PolarHBondContact O-OG1 3.42Å
493	I	56.6	Low	51	Low	74 Å²	74	102.5 Å²	102.5	38%	0.379	52%	0.519	S	S	.	.	H	α-helix	trans	-67.8	-47.1	173.3	-68.8	172.1	0	0	0	109.5	F489 Q490 M491 E495 T496 L497	F489-I493 HydrophobicContact CD1-CD1 3.87Å; F489-I493 HydrophobicContact CE1-CD1 3.43Å; F489-I493 VanDerWaalsContact CE1-CD1 3.43Å; F489-I493 HydrophobicContact CE1-CG1 4.43Å; F489-I493 HydrophobicContact CZ-CD1 3.83Å; F489-I493 HydrophobicContact CZ-CG1 4.49Å; F489-I493 PolarHBondContact O-N 3.25Å; Q490-I493 PolarHBondContact O-N 3.15Å; M491-I493 VanDerWaalsContact C-N 3.32Å; M491-I493 PolarHBondContact O-N 3.11Å; I493-E495 PolarHBondContact O-N 3.16Å; I493-T496 WeakPolarHBondContact O-CB 3.47Å; I493-T496 PolarHBondContact O-N 3.23Å; I493-T496 VanDerWaalsContact O-N 3.12Å; I493-L497 HydrophobicContact CG2-CD1 3.95Å; I493-L497 HydrophobicContact CG2-CG 4.34Å; I493-L497 WeakPolarHBondContact O-CG 3.4Å; I493-L497 PolarHBondContact O-N 3.42Å
494	L	55	Low	51.8	Low	77 Å²	77	97 Å²	97	40%	0.403	50%	0.502	S	S	.	.	H	α-helix	trans	-60.6	-44.1	176.8	-71.8	171.6	0	0	0	111.9	I486 Q490 M491 T496 L497 E498	I486-L494 HydrophobicContact CD1-CD1 4.37Å; Q490-L494 WeakPolarHBondContact O-CG 3.32Å; Q490-L494 PolarHBondContact O-N 3.04Å; M491-L494 PolarHBondContact O-N 3.26Å; M491-L494 HydrophobicContact SD-CD1 4.5Å; L494-T496 VanDerWaalsContact C-N 3.29Å; L494-T496 PolarHBondContact O-N 2.96Å; L494-L497 PolarHBondContact O-N 3.1Å; L494-E498 WeakPolarHBondContact O-CB 3.48Å; L494-E498 WeakPolarHBondContact O-CG 3.5Å; L494-E498 PolarHBondContact O-N 3.28Å
495	E	61.6	Low	52.4	Low	105 Å²	105	94.7 Å²	94.7	49%	0.491	48%	0.484	S	S	.	.	H	α-helix	trans	-61.4	-36.5	174	-81.2	-176	169.6	0	0	112.4	M491 I493 K499	M491-E495 PolarHBondContact O-N 3.26Å; I493-E495 PolarHBondContact O-N 3.16Å; E495-K499 WeakPolarHBondContact O-CB 3.29Å; E495-K499 WeakPolarHBondContact O-CG 3.36Å; E495-K499 PolarHBondContact O-N 3.39Å
496	T	58.8	Low	53	Low	75 Å²	75	92.9 Å²	92.9	46%	0.46	47%	0.47	S	S	.	.	H	α-helix	trans	-69.9	-39.1	176.9	-56.7	0	0	0	0	111.1	S492 I493 L494 K500	S492-T496 WeakPolarHBondContact O-CB 3.34Å; S492-T496 PolarHBondContact O-N 3.11Å; S492-T496 PolarHBondContact O-OG1 3.42Å; I493-T496 WeakPolarHBondContact O-CB 3.47Å; I493-T496 PolarHBondContact O-N 3.23Å; I493-T496 VanDerWaalsContact O-N 3.12Å; L494-T496 VanDerWaalsContact C-N 3.29Å; L494-T496 PolarHBondContact O-N 2.96Å; T496-K500 WeakPolarHBondContact O-CB 3.45Å; T496-K500 WeakPolarHBondContact O-CG 3.48Å; T496-K500 PolarHBondContact O-N 3.02Å
497	L	53.9	Low	53.2	Low	87 Å²	87	90.7 Å²	90.7	46%	0.455	46%	0.459	S	S	.	.	H	α-helix	trans	-68.3	-40.9	175.8	-69.3	173.7	0	0	0	111.8	I493 L494 K500 K501	I493-L497 HydrophobicContact CG2-CD1 3.95Å; I493-L497 HydrophobicContact CG2-CG 4.34Å; I493-L497 WeakPolarHBondContact O-CG 3.4Å; I493-L497 PolarHBondContact O-N 3.42Å; L494-L497 PolarHBondContact O-N 3.1Å; L497-K500 PolarHBondContact O-N 2.91Å; L497-K501 WeakPolarHBondContact O-CB 3.27Å; L497-K501 PolarHBondContact O-N 3.27Å
498	E	58.1	Low	52.6	Low	140 Å²	140	90 Å²	90	65%	0.654	46%	0.458	S	S	*	.	H	α-helix	trans	-64.2	-42.6	174.6	-77.3	-178.3	167.5	0	0	111.8	L494 K500 K501 S502	L494-E498 WeakPolarHBondContact O-CB 3.48Å; L494-E498 WeakPolarHBondContact O-CG 3.5Å; L494-E498 PolarHBondContact O-N 3.28Å; E498-K500 PolarHBondContact O-N 3.45Å; E498-K501 PolarHBondContact O-N 3.31Å; E498-S502 PolarHBondContact O-N 2.82Å
499	K	60	Low	52.4	Low	140 Å²	140	89.7 Å²	89.7	61%	0.609	45%	0.451	S	S	*	.	H	α-helix	trans	-60.4	-45.6	173.1	-79.2	175.3	-178.1	171.1	0	111.5	E495 S502 I503	E495-K499 WeakPolarHBondContact O-CB 3.29Å; E495-K499 WeakPolarHBondContact O-CG 3.36Å; E495-K499 PolarHBondContact O-N 3.39Å; K499-S502 PolarHBondContact O-N 2.63Å; K499-S502 PolarHBondContact O-OG 3.31Å; K499-I503 WeakPolarHBondContact O-CG1 3.31Å; K499-I503 PolarHBondContact O-N 3.34Å; K499-I503 VanDerWaalsContact O-N 3.14Å
500	K	56.9	Low	51.9	Low	85 Å²	85	84.6 Å²	84.6	37%	0.37	43%	0.434	S	S	.	.	H	α-helix	trans	-60.9	-44.5	175.8	-77.3	-177.5	176.9	-169.5	0	111.9	T496 L497 E498 S502 I503 F504	T496-K500 WeakPolarHBondContact O-CB 3.45Å; T496-K500 WeakPolarHBondContact O-CG 3.48Å; T496-K500 PolarHBondContact O-N 3.02Å; L497-K500 PolarHBondContact O-N 2.91Å; E498-K500 PolarHBondContact O-N 3.45Å; K500-S502 VanDerWaalsContact C-N 3.34Å; K500-S502 PolarHBondContact O-N 3.48Å; K500-I503 WeakPolarHBondContact O-CB 3.44Å; K500-I503 PolarHBondContact O-N 2.8Å; K500-I503 VanDerWaalsContact O-N 3.12Å; K500-F504 WeakPolarHBondContact O-CD2 3.29Å; K500-F504 PolarHBondContact O-N 3.33Å; K500-F504 VanDerWaalsContact O-N 3.14Å
501	K	50.6	Low	51.9	Low	139 Å²	139	83.8 Å²	83.8	60%	0.604	43%	0.431	S	S	*	.	H	α-helix	trans	-58.9	-44.2	176.4	-171	177.7	177.2	-179.5	0	111.6	L497 E498 I503 F504 D505	L497-K501 WeakPolarHBondContact O-CB 3.27Å; L497-K501 PolarHBondContact O-N 3.27Å; E498-K501 PolarHBondContact O-N 3.31Å; K501-I503 VanDerWaalsContact C-N 3.27Å; K501-I503 PolarHBondContact O-N 3.37Å; K501-F504 PolarHBondContact O-N 2.65Å; K501-D505 PolarHBondContact O-N 3.19Å
502	S	48.8	Very low	51.6	Low	53 Å²	53	84.3 Å²	84.3	37%	0.371	43%	0.434	S	S	.	.	H	α-helix	trans	-61.4	-33.8	176.2	84.6	0	0	0	0	113	E498 K499 K500 N506	E498-S502 PolarHBondContact O-N 2.82Å; K499-S502 PolarHBondContact O-N 2.63Å; K499-S502 PolarHBondContact O-OG 3.31Å; K500-S502 VanDerWaalsContact C-N 3.34Å; K500-S502 PolarHBondContact O-N 3.48Å; S502-N506 VanDerWaalsContact O-CB 3.26Å; S502-N506 WeakPolarHBondContact O-CB 3.2Å; S502-N506 PolarHBondContact O-N 3.22Å; S502-N506 PolarHBondContact O-ND2 3.14Å
503	I	49.4	Very low	51.3	Low	61 Å²	61	88 Å²	88	31%	0.313	45%	0.446	S	S	.	.	H	α-helix	trans	-66.8	-46.7	177.2	-67.7	164	0	0	0	109.9	Y152 K499 K500 K501 N506 I507	Y152-I503 HydrophobicContact CE2-CG2 4.45Å; K499-I503 WeakPolarHBondContact O-CG1 3.31Å; K499-I503 PolarHBondContact O-N 3.34Å; K499-I503 VanDerWaalsContact O-N 3.14Å; K500-I503 WeakPolarHBondContact O-CB 3.44Å; K500-I503 PolarHBondContact O-N 2.8Å; K500-I503 VanDerWaalsContact O-N 3.12Å; K501-I503 VanDerWaalsContact C-N 3.27Å; K501-I503 PolarHBondContact O-N 3.37Å; I503-N506 PolarHBondContact O-N 2.85Å; I503-I507 HydrophobicContact CG2-CD1 3.79Å; I503-I507 VanDerWaalsContact O-CG1 3.24Å; I503-I507 WeakPolarHBondContact O-CG1 3.45Å; I503-I507 PolarHBondContact O-N 3.4Å
504	F	44.3	Very low	51	Low	127 Å²	127	90.3 Å²	90.3	56%	0.557	45%	0.45	S	S	*	.	H	α-helix	trans	-65.2	-40.6	177.5	-71.5	-70	0	0	0	112.4	K500 K501 I507 G508	K500-F504 WeakPolarHBondContact O-CD2 3.29Å; K500-F504 PolarHBondContact O-N 3.33Å; K500-F504 VanDerWaalsContact O-N 3.14Å; K501-F504 PolarHBondContact O-N 2.65Å; F504-I507 PolarHBondContact O-N 2.84Å; F504-G508 PolarHBondContact O-N 3.45Å
505	D	46.2	Very low	50.7	Low	88 Å²	88	93.4 Å²	93.4	47%	0.471	46%	0.46	S	S	.	.	H	α-helix	trans	-63	-43.4	176.2	-69.4	-22.8	0	0	0	111.2	K501 G508 I509	K501-D505 PolarHBondContact O-N 3.19Å; D505-G508 PolarHBondContact O-N 3.09Å; D505-I509 VanDerWaalsContact O-CG1 3.28Å; D505-I509 WeakPolarHBondContact O-CG1 3.3Å; D505-I509 PolarHBondContact O-N 3.07Å
506	N	49.8	Very low	50	Low	88 Å²	88	94.3 Å²	94.3	47%	0.471	46%	0.464	S	S	.	.	H	α-helix	trans	-67.1	-37.4	177.9	-74.7	-34.4	0	0	0	112.9	S502 I503 S510	S502-N506 VanDerWaalsContact O-CB 3.26Å; S502-N506 WeakPolarHBondContact O-CB 3.2Å; S502-N506 PolarHBondContact O-N 3.22Å; S502-N506 PolarHBondContact O-ND2 3.14Å; I503-N506 PolarHBondContact O-N 2.85Å; N506-S510 WeakPolarHBondContact O-CB 3.45Å; N506-S510 PolarHBondContact O-N 3.34Å
507	I	51.7	Low	49.4	Very low	46 Å²	46	93.4 Å²	93.4	24%	0.236	47%	0.465	C	S	.	.	H	α-helix	trans	-64.5	-45.7	173.2	-69	166.1	0	0	0	109.8	I503 F504 I509 S510 I511	I503-I507 HydrophobicContact CG2-CD1 3.79Å; I503-I507 VanDerWaalsContact O-CG1 3.24Å; I503-I507 WeakPolarHBondContact O-CG1 3.45Å; I503-I507 PolarHBondContact O-N 3.4Å; F504-I507 PolarHBondContact O-N 2.84Å; I507-I509 PolarHBondContact O-N 2.68Å; I507-S510 PolarHBondContact O-N 3.18Å; I507-I511 HydrophobicContact CG2-CD1 3.65Å; I507-I511 HydrophobicContact CG2-CG1 4.35Å; I507-I511 WeakPolarHBondContact O-CB 3.49Å; I507-I511 VanDerWaalsContact O-CG1 3.24Å; I507-I511 WeakPolarHBondContact O-CG1 3.47Å; I507-I511 PolarHBondContact O-N 2.81Å
508	G	42	Very low	49.1	Very low	30 Å²	30	95.6 Å²	95.6	31%	0.309	48%	0.476	S	S	.	.	H	α-helix	trans	-58	-45.5	176.3	0	0	0	0	0	112.9	F504 D505 M512	F504-G508 PolarHBondContact O-N 3.45Å; D505-G508 PolarHBondContact O-N 3.09Å; G508-M512 PolarHBondContact O-N 3.47Å; G508-M512 VanDerWaalsContact O-N 3.11Å
509	I	48.8	Very low	48.4	Very low	83 Å²	83	92.7 Å²	92.7	43%	0.426	47%	0.465	S	S	.	.	H	α-helix	trans	-65.6	-44.1	177	-67.2	165.9	0	0	0	111.2	D505 I507 I511 M512 Q513	D505-I509 VanDerWaalsContact O-CG1 3.28Å; D505-I509 WeakPolarHBondContact O-CG1 3.3Å; D505-I509 PolarHBondContact O-N 3.07Å; I507-I509 PolarHBondContact O-N 2.68Å; I509-I511 PolarHBondContact O-N 3.48Å; I509-M512 PolarHBondContact O-N 3.23Å; I509-Q513 HydrophobicContact CG2-CG 4.23Å; I509-Q513 WeakPolarHBondContact O-CG 3.28Å; I509-Q513 PolarHBondContact O-N 3.38Å
510	S	41.6	Very low	48	Very low	38 Å²	38	91.7 Å²	91.7	27%	0.266	47%	0.466	S	S	.	.	H	α-helix	trans	-66.6	-36.9	-178.9	-162.2	0	0	0	0	112.4	N506 I507 R514	N506-S510 WeakPolarHBondContact O-CB 3.45Å; N506-S510 PolarHBondContact O-N 3.34Å; I507-S510 PolarHBondContact O-N 3.18Å; S510-R514 WeakPolarHBondContact O-CG 3.29Å; S510-R514 PolarHBondContact O-N 2.82Å; S510-R514 VanDerWaalsContact O-N 3.11Å
511	I	47.2	Very low	47.4	Very low	86 Å²	86	97.5 Å²	97.5	44%	0.441	49%	0.487	S	S	.	.	H	α-helix	trans	-63.4	-45.1	173	-68.8	168.5	0	0	0	110.3	I507 I509 R514 K515	I507-I511 HydrophobicContact CG2-CD1 3.65Å; I507-I511 HydrophobicContact CG2-CG1 4.35Å; I507-I511 WeakPolarHBondContact O-CB 3.49Å; I507-I511 VanDerWaalsContact O-CG1 3.24Å; I507-I511 WeakPolarHBondContact O-CG1 3.47Å; I507-I511 PolarHBondContact O-N 2.81Å; I509-I511 PolarHBondContact O-N 3.48Å; I511-R514 PolarHBondContact O-N 3.09Å; I511-K515 PolarHBondContact O-N 3.05Å; I511-K515 VanDerWaalsContact O-N 3.13Å
512	M	46.8	Very low	47	Very low	99 Å²	99	94.2 Å²	94.2	49%	0.488	49%	0.492	S	S	.	.	H	α-helix	trans	-65.9	-45.3	178.4	-76	-158.1	-100.5	0	0	112.6	G508 I509 R514 K515 H516	G508-M512 PolarHBondContact O-N 3.47Å; G508-M512 VanDerWaalsContact O-N 3.11Å; I509-M512 PolarHBondContact O-N 3.23Å; M512-R514 VanDerWaalsContact C-N 3.31Å; M512-R514 PolarHBondContact O-N 3.07Å; M512-K515 PolarHBondContact O-N 3.24Å; M512-K515 VanDerWaalsContact O-N 3.15Å; M512-H516 PolarHBondContact O-CD2 3.42Å; M512-H516 PolarHBondContact O-N 2.78Å
513	Q	49.3	Very low	46.7	Very low	128 Å²	128	96.2 Å²	96.2	60%	0.598	51%	0.507	S	S	*	.	H	α-helix	trans	-61.7	-37	178.7	-73.6	177	-11.2	0	0	112.6	I509 H516 A517	I509-Q513 HydrophobicContact CG2-CG 4.23Å; I509-Q513 WeakPolarHBondContact O-CG 3.28Å; I509-Q513 PolarHBondContact O-N 3.38Å; Q513-H516 PolarHBondContact O-N 2.87Å; Q513-A517 PolarHBondContact O-N 2.78Å
514	R	50.2	Low	46.2	Very low	121 Å²	121	102.3 Å²	102.3	46%	0.457	53%	0.531	S	S	.	.	H	α-helix	trans	-69.7	-35.7	174.9	-75.5	-178	-169.8	145.3	3.3	112.7	S510 I511 M512 A517 L518	S510-R514 WeakPolarHBondContact O-CG 3.29Å; S510-R514 PolarHBondContact O-N 2.82Å; S510-R514 VanDerWaalsContact O-N 3.11Å; I511-R514 PolarHBondContact O-N 3.09Å; M512-R514 VanDerWaalsContact C-N 3.31Å; M512-R514 PolarHBondContact O-N 3.07Å; R514-A517 PolarHBondContact O-N 3.5Å; R514-L518 WeakPolarHBondContact O-CG 3.43Å; R514-L518 PolarHBondContact O-N 2.84Å
515	K	48	Very low	45.6	Very low	143 Å²	143	101.6 Å²	101.6	62%	0.622	54%	0.542	S	S	*	.	H	α-helix	trans	-63.1	-44.7	174	-167.1	173.5	179	174.3	0	110.8	I511 M512 A517 L518 D519	I511-K515 PolarHBondContact O-N 3.05Å; I511-K515 VanDerWaalsContact O-N 3.13Å; M512-K515 PolarHBondContact O-N 3.24Å; M512-K515 VanDerWaalsContact O-N 3.15Å; K515-A517 PolarHBondContact O-N 3.49Å; K515-L518 PolarHBondContact O-N 3.13Å; K515-D519 VanDerWaalsContact O-CG 3.26Å; K515-D519 PolarHBondContact O-N 3.08Å
516	H	48.3	Very low	45.1	Very low	123 Å²	123	106.6 Å²	106.6	57%	0.569	56%	0.562	S	S	*	*	H	α-helix	trans	-60.6	-40.7	173.8	-75.1	-69	0	0	0	113.3	M512 Q513 L518 D519 D520	M512-H516 PolarHBondContact O-CD2 3.42Å; M512-H516 PolarHBondContact O-N 2.78Å; Q513-H516 PolarHBondContact O-N 2.87Å; H516-L518 VanDerWaalsContact C-N 3.34Å; H516-L518 PolarHBondContact O-N 2.73Å; H516-D519 PolarHBondContact O-N 3Å; H516-D520 PolarHBondContact O-N 2.76Å; H516-D520 VanDerWaalsContact O-N 3.09Å
517	A	45.9	Very low	44.4	Very low	57 Å²	57	108.3 Å²	108.3	47%	0.471	58%	0.581	S	S	.	*	H	α-helix	trans	-68.6	-30	178.3	0	0	0	0	0	113.6	Q513 R514 K515 Y521	Q513-A517 PolarHBondContact O-N 2.78Å; R514-A517 PolarHBondContact O-N 3.5Å; K515-A517 PolarHBondContact O-N 3.49Å; A517-Y521 PolarHBondContact O-N 3.29Å
518	L	47.5	Very low	43.7	Very low	133 Å²	133	111 Å²	111	70%	0.696	61%	0.61	S	S	*	*	H	α-helix	trans	-76.5	-36.2	174.8	-70.8	170.8	0	0	0	111.8	R514 K515 H516 Y521 G522	R514-L518 WeakPolarHBondContact O-CG 3.43Å; R514-L518 PolarHBondContact O-N 2.84Å; K515-L518 PolarHBondContact O-N 3.13Å; H516-L518 VanDerWaalsContact C-N 3.34Å; H516-L518 PolarHBondContact O-N 2.73Å; L518-Y521 PolarHBondContact O-N 3.49Å; L518-G522 PolarHBondContact O-N 2.93Å
519	D	44.1	Very low	43.3	Very low	79 Å²	79	114.5 Å²	114.5	42%	0.422	64%	0.636	S	S	.	*	H	α-helix	trans	-70.7	-31.6	177.6	-65.2	-23.1	0	0	0	112.4	K515 H516 S523	K515-D519 VanDerWaalsContact O-CG 3.26Å; K515-D519 PolarHBondContact O-N 3.08Å; H516-D519 PolarHBondContact O-N 3Å; D519-S523 PolarHBondContact O-OG 3.41Å
520	D	50.4	Low	42.6	Very low	118 Å²	118	116.6 Å²	116.6	63%	0.631	66%	0.655	S	S	*	*	H	α-helix	trans	-77.1	-25.3	176.7	-87.5	-11.9	0	0	0	113.6	H516	H516-D520 PolarHBondContact O-N 2.76Å; H516-D520 VanDerWaalsContact O-N 3.09Å
521	Y	45.6	Very low	42.3	Very low	208 Å²	208	118.9 Å²	118.9	82%	0.816	68%	0.676	S	S	*	*	H	α-helix	trans	-81.1	-21.6	174.3	-108.1	-92.6	0	0	0	113.1	A517 L518 S523	A517-Y521 PolarHBondContact O-N 3.29Å; L518-Y521 PolarHBondContact O-N 3.49Å; Y521-S523 VanDerWaalsContact C-N 3.33Å; Y521-S523 PolarHBondContact O-N 3.06Å
522	G	42	Very low	41.7	Very low	69 Å²	69	124 Å²	124	71%	0.711	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-3.7	177.9	0	0	0	0	0	115.6	L518	L518-G522 PolarHBondContact O-N 2.93Å
523	S	42.6	Very low	41.3	Very low	96 Å²	96	128.8 Å²	128.8	67%	0.671	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	14.1	-170.6	-52.2	0	0	0	0	114.6	D519 Y521	D519-S523 PolarHBondContact O-OG 3.41Å; Y521-S523 VanDerWaalsContact C-N 3.33Å; Y521-S523 PolarHBondContact O-N 3.06Å
524	K	38.9	Very low	40.7	Very low	189 Å²	189	127 Å²	127	82%	0.822	72%	0.721	S	S	*	*	S	Bend	trans	-141	70.6	179.3	-75.1	-175.4	178.3	174.2	0	112.9
525	S	31.7	Very low	40	Very low	112 Å²	112	126.5 Å²	126.5	78%	0.783	74%	0.742	S	S	*	*			trans	-172.5	88.4	154.7	55.4	0	0	0	0	111.5
526	E	34	Very low	39.3	Very low	193 Å²	193	123.5 Å²	123.5	90%	0.902	75%	0.752	S	S	*	*			trans	-163.1	89.1	159.5	-112.4	171.6	-166.8	0	0	109.2
527	S	35.1	Very low	38.6	Very low	124 Å²	124	122.3 Å²	122.3	87%	0.867	76%	0.758	S	S	*	*			trans	170.5	91.4	152.1	41.5	0	0	0	0	110.4
528	A	37.2	Very low	38.4	Very low	102 Å²	102	127.9 Å²	127.9	84%	0.843	77%	0.774	S	S	*	*			trans	-169.6	108.8	149.3	0	0	0	0	0	109.5
529	A	34.3	Very low	37.9	Very low	103 Å²	103	126.8 Å²	126.8	85%	0.851	78%	0.777	S	S	*	*			trans	-69.6	150.5	172.7	0	0	0	0	0	111.7
530	P	33.8	Very low	37.2	Very low	127 Å²	127	128.4 Å²	128.4	83%	0.825	79%	0.794	S	S	*	*			trans	-106.4	149.7	-174.3	37.8	-29.6	0	0	0	113.3
531	A	34.7	Very low	36.6	Very low	87 Å²	87	128.4 Å²	128.4	72%	0.719	80%	0.801	S	S	*	*			trans	-176.5	120.9	148.1	0	0	0	0	0	115.2
532	K	36	Very low	35.9	Very low	193 Å²	193	124.5 Å²	124.5	84%	0.839	80%	0.799	S	S	*	*			trans	74.5	110.8	132.8	-62.2	177.2	-178.8	179.6	0	120.6
533	K	37	Very low	35.5	Very low	199 Å²	199	128.4 Å²	128.4	87%	0.865	81%	0.809	S	S	*	*				164.3	140.7	100.9	-98.5	174.2	179.2	-179.9	0	114.5
534	A	37	Very low	35	Very low	92 Å²	92	127 Å²	127	76%	0.76	81%	0.809	S	S	*	*			trans	61	110.3	144.1	0	0	0	0	0	119.3
535	A	35.1	Very low	34.7	Very low	109 Å²	109	124.1 Å²	124.1	90%	0.901	81%	0.813	S	S	*	*				89.6	123.1	75.8	0	0	0	0	0	113.3
536	G	34.6	Very low	34.9	Very low	81 Å²	81	124.1 Å²	124.1	84%	0.835	81%	0.81	S	S	*	*			trans	161.6	94.6	172.8	0	0	0	0	0	113.3
537	S	33.8	Very low	34.6	Very low	97 Å²	97	124.8 Å²	124.8	68%	0.678	81%	0.81	S	S	*	*			trans	-63.3	155.9	173.9	45.6	0	0	0	0	114.3
538	H	40.6	Very low	34.2	Very low	175 Å²	175	124.8 Å²	124.8	81%	0.81	81%	0.805	S	S	*	*				174.8	120	121.3	-89.3	-65.5	0	0	0	113.8
539	S	37.8	Very low	33.8	Very low	109 Å²	109	127.7 Å²	127.7	76%	0.762	81%	0.805	S	S	*	*			trans	56.8	117	139.6	59.1	0	0	0	0	123.9
540	S	29.2	Very low	33.5	Very low	113 Å²	113	131.4 Å²	131.4	79%	0.79	80%	0.802	S	S	*	*			trans	-59.7	-179.5	149.8	-27.1	0	0	0	0	112.7
541	P	37.4	Very low	33	Very low	118 Å²	118	135.5 Å²	135.5	77%	0.766	81%	0.807	S	S	*	*			cis	-151.3	174	38.3	38.8	-13.6	0	0	0	120
542	T	31	Very low	32.7	Very low	126 Å²	126	137.6 Å²	137.6	77%	0.773	81%	0.81	S	S	*	*			trans	-21.3	152.2	162.4	48.6	0	0	0	0	122.2
543	V	34.3	Very low	32.1	Very low	152 Å²	152	134 Å²	134	92%	0.921	81%	0.81	S	S	*	*				165.4	138.6	129.7	171.5	0	0	0	0	106.9
544	G	32.1	Very low	31.7	Very low	66 Å²	66	128.8 Å²	128.8	68%	0.68	80%	0.803	S	S	*	*			cis	-179.8	152.3	1.9	0	0	0	0	0	111.2
545	S	32	Very low	31	Very low	129 Å²	129	134.2 Å²	134.2	90%	0.902	80%	0.804	S	S	*	*			trans	37.4	157.3	145.4	-100	0	0	0	0	125.7
546	P	35	Very low	30.8	Very low	112 Å²	112	134.8 Å²	134.8	73%	0.727	80%	0.798	S	S	*	*			trans	-110.1	167.4	-147.6	41.5	-31.8	0	0	0	115
547	F	27.9	Very low	30.5	Very low	206 Å²	206	138 Å²	138	90%	0.904	79%	0.791	S	S	*	*			trans	-112.6	120.4	173	-112.6	-92	0	0	0	113.2
548	V	27.1	Very low	30.4	Very low	125 Å²	125	138.8 Å²	138.8	76%	0.758	80%	0.797	S	S	*	*			trans	-71.8	132.8	165.1	172.1	0	0	0	0	109.4
549	I	29.5	Very low	29.9	Very low	162 Å²	162	134.9 Å²	134.9	83%	0.831	80%	0.795	S	S	*	*			trans	-117.2	122.9	162.8	-62	-179.2	0	0	0	109.9
550	K	28.7	Very low	29.6	Very low	181 Å²	181	134.7 Å²	134.7	79%	0.787	80%	0.8	S	S	*	*			trans	-61.9	143.1	-178.4	-74.4	169.2	171.3	172.1	0	112.8	V552	K550-V552 PolarHBondContact O-N 3.4Å
551	K	22.8	Very low	29.7	Very low	214 Å²	214	138.3 Å²	138.3	93%	0.93	80%	0.802	S	S	*	*			trans	-51.7	123.6	156.3	-94.5	174.5	172.7	171.2	0	109.9
552	V	28.1	Very low	29.4	Very low	131 Å²	131	138.1 Å²	138.1	79%	0.794	80%	0.8	S	S	*	*			trans	-120.4	118	156	177.8	0	0	0	0	107.5	K550	K550-V552 PolarHBondContact O-N 3.4Å
553	S	23.9	Very low	29.3	Very low	118 Å²	118	138.9 Å²	138.9	83%	0.825	80%	0.804	S	S	*	*			trans	-67.4	120.4	169.5	167.5	0	0	0	0	109.3
554	A	28.3	Very low	29.3	Very low	88 Å²	88	137.7 Å²	137.7	73%	0.727	80%	0.798	S	S	*	*			trans	-138.4	117.4	162.5	0	0	0	0	0	108.7
555	R	22.7	Very low	29.5	Very low	207 Å²	207	142.4 Å²	142.4	78%	0.781	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-88.8	125	172.7	-177.8	-174.5	-169.6	-152	3.2	107.7
556	P	30.2	Very low	29.8	Very low	120 Å²	120	137.2 Å²	137.2	78%	0.779	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-103.8	118.5	157.2	14.4	4.2	0	0	0	109.4
557	Q	27.2	Very low	30	Very low	148 Å²	148	137.5 Å²	137.5	69%	0.692	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-75.7	125.3	155.6	-59.2	173.6	8.4	0	0	107.2
558	S	33.5	Very low	30.9	Very low	115 Å²	115	132.7 Å²	132.7	80%	0.804	75%	0.75	S	S	*	*			trans	173.6	131.1	140.1	56.3	0	0	0	0	111.2
559	A	29.2	Very low	32.2	Very low	93 Å²	93	129.1 Å²	129.1	77%	0.769	73%	0.726	S	S	*	*			trans	-62	128	178.4	0	0	0	0	0	113.1	K561	A559-K561 PolarHBondContact O-N 2.92Å
560	A	32.3	Very low	33.1	Very low	104 Å²	104	130.1 Å²	130.1	86%	0.86	73%	0.725	S	S	*	*			trans	-77.8	108.5	158.7	0	0	0	0	0	108.3
561	K	30.9	Very low	34.3	Very low	189 Å²	189	126.2 Å²	126.2	82%	0.822	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-66	144.2	170.5	-73.1	177.7	178.8	176.3	0	109.5	A559 V563	A559-K561 PolarHBondContact O-N 2.92Å; K561-V563 PolarHBondContact O-N 3.16Å
562	P	30.5	Very low	35.8	Very low	114 Å²	114	125.1 Å²	125.1	74%	0.74	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-62.4	136.5	177.9	25.8	-32.8	0	0	0	110.8	T564	P562-T564 PolarHBondContact O-N 3.25Å
563	V	29.3	Very low	36.5	Very low	142 Å²	142	126.4 Å²	126.4	86%	0.861	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-58	116.9	166.9	175.9	0	0	0	0	107.5	K561	K561-V563 PolarHBondContact O-N 3.16Å
564	T	34.2	Very low	37	Very low	127 Å²	127	124.3 Å²	124.3	78%	0.779	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-81.3	120.2	174	26.4	0	0	0	0	108.6	P562 G566	P562-T564 PolarHBondContact O-N 3.25Å; T564-G566 PolarHBondContact O-N 3.27Å
565	L	36.3	Very low	37.3	Very low	166 Å²	166	126.7 Å²	126.7	87%	0.869	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-53.3	126.2	171	-89.1	149.2	0	0	0	109.7
566	G	38.1	Very low	38.1	Very low	19 Å²	19	120.6 Å²	120.6	20%	0.196	67%	0.667	C	S	.	*	P	Polyproline II helix	trans	-60.9	147.1	179.5	0	0	0	0	0	112.5	T564	T564-G566 PolarHBondContact O-N 3.27Å
567	T	39.9	Very low	38.2	Very low	119 Å²	119	121.6 Å²	121.6	73%	0.73	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-71.6	131.6	175	49.1	0	0	0	0	110.6	D569	T567-D569 PolarHBondContact O-N 3.28Å
568	Y	46.4	Very low	38.7	Very low	105 Å²	105	124.1 Å²	124.1	41%	0.412	67%	0.674	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.5	118.3	173.1	-178.1	-101.4	0	0	0	110.6	K570 F575	Y568-K570 HydrophobicContact CD1-CG 3.85Å; Y568-K570 HydrophobicContact CE1-CB 4.47Å; Y568-K570 HydrophobicContact CE1-CG 3.94Å; Y568-K570 PolarHBondContact O-N 3.28Å; Y568-F575 AromaticContact CD2-CD2 3.99Å; Y568-F575 HydrophobicContact CD2-CD2 3.99Å; Y568-F575 HydrophobicContact CD2-CE1 4.37Å; Y568-F575 AromaticContact CD2-CE2 3.66Å; Y568-F575 HydrophobicContact CD2-CE2 3.66Å; Y568-F575 HydrophobicContact CD2-CG 4.49Å; Y568-F575 AromaticContact CD2-CZ 3.87Å; Y568-F575 HydrophobicContact CD2-CZ 3.87Å; Y568-F575 HydrophobicContact CE2-CE2 4.25Å; Y568-F575 HydrophobicContact CG-CZ 4.49Å
569	D	55.1	Low	38.6	Very low	50 Å²	50	125.7 Å²	125.7	27%	0.267	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.6	103.6	172.2	-177.4	-6.7	0	0	0	109.7	T567 S571 R572 K573 V574	T567-D569 PolarHBondContact O-N 3.28Å; D569-S571 VanDerWaalsContact CG-OG 3.32Å; D569-S571 PolarHBondContact O-N 3.26Å; D569-S571 WeakPolarHBondContact OD1-CB 3.44Å; D569-S571 PolarHBondContact OD1-N 3.37Å; D569-S571 PolarHBondContact OD1-OG 3.48Å; D569-S571 PolarHBondContact OD2-OG 3.33Å; D569-R572 PolarHBondContact O-N 3.31Å; D569-R572 WeakPolarHBondContact OD2-CD 3.4Å; D569-R572 WeakPolarHBondContact OD2-CG 3.44Å; D569-K573 PolarHBondContact O-N 3.25Å; D569-V574 PolarHBondContact N-O 3.3Å
570	K	47.7	Very low	38.7	Very low	182 Å²	182	127.1 Å²	127.1	79%	0.791	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-25.2	177.9	-72.4	-175.1	178.4	-179.8	0	113.3	Y568	Y568-K570 HydrophobicContact CD1-CG 3.85Å; Y568-K570 HydrophobicContact CE1-CB 4.47Å; Y568-K570 HydrophobicContact CE1-CG 3.94Å; Y568-K570 PolarHBondContact O-N 3.28Å
571	S	53.6	Low	38.7	Very low	100 Å²	100	134.4 Å²	134.4	70%	0.699	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-29.5	-178.3	72	0	0	0	0	112.8	D569	D569-S571 VanDerWaalsContact CG-OG 3.32Å; D569-S571 PolarHBondContact O-N 3.26Å; D569-S571 WeakPolarHBondContact OD1-CB 3.44Å; D569-S571 PolarHBondContact OD1-N 3.37Å; D569-S571 PolarHBondContact OD1-OG 3.48Å; D569-S571 PolarHBondContact OD2-OG 3.33Å
572	R	53.2	Low	38.7	Very low	191 Å²	191	128.8 Å²	128.8	72%	0.721	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	-4.7	-176.3	-62	-177.1	178.9	-162.4	-1.1	114.6	D569 V574	D569-R572 PolarHBondContact O-N 3.31Å; D569-R572 WeakPolarHBondContact OD2-CD 3.4Å; D569-R572 WeakPolarHBondContact OD2-CG 3.44Å; R572-V574 HydrophobicContact CB-CG2 3.53Å; R572-V574 PolarHBondContact O-N 3.41Å
573	K	43.8	Very low	38.7	Very low	158 Å²	158	131.8 Å²	131.8	69%	0.687	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.6	34.5	-176.4	-62.1	-177.3	178.6	177.2	0	113.4	D569	D569-K573 PolarHBondContact O-N 3.25Å
574	V	34.1	Very low	38.6	Very low	74 Å²	74	132 Å²	132	45%	0.448	68%	0.677	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.6	144.4	177.6	-82.7	0	0	0	0	111	D569 R572	D569-V574 PolarHBondContact N-O 3.3Å; R572-V574 HydrophobicContact CB-CG2 3.53Å; R572-V574 PolarHBondContact O-N 3.41Å
575	F	35.6	Very low	38.5	Very low	137 Å²	137	133 Å²	133	60%	0.601	67%	0.673	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.3	120.5	167.1	-84.3	-86.7	0	0	0	109.1	Y568	Y568-F575 AromaticContact CD2-CD2 3.99Å; Y568-F575 HydrophobicContact CD2-CD2 3.99Å; Y568-F575 HydrophobicContact CD2-CE1 4.37Å; Y568-F575 AromaticContact CD2-CE2 3.66Å; Y568-F575 HydrophobicContact CD2-CE2 3.66Å; Y568-F575 HydrophobicContact CD2-CG 4.49Å; Y568-F575 AromaticContact CD2-CZ 3.87Å; Y568-F575 HydrophobicContact CD2-CZ 3.87Å; Y568-F575 HydrophobicContact CE2-CE2 4.25Å; Y568-F575 HydrophobicContact CG-CZ 4.49Å
576	V	38.2	Very low	38.2	Very low	80 Å²	80	129.8 Å²	129.8	49%	0.485	67%	0.665	S	S	.	*			trans	-94.3	104.8	175.4	-177	0	0	0	0	108.3	K578	V576-K578 PolarHBondContact O-N 3.25Å
577	L	32.8	Very low	38	Very low	140 Å²	140	137.5 Å²	137.5	73%	0.733	70%	0.695	S	S	*	*			trans	-76.2	115.3	170.3	-70.1	172.1	0	0	0	109.1	L579	L577-L579 PolarHBondContact O-N 3.3Å
578	K	36.9	Very low	37.5	Very low	201 Å²	201	141.6 Å²	141.6	87%	0.874	70%	0.703	S	S	*	*			trans	-91.5	92.5	175.2	-152.2	172.9	-171.5	175.5	0	108.7	V576	V576-K578 PolarHBondContact O-N 3.25Å
579	L	31.7	Very low	37	Very low	149 Å²	149	143 Å²	143	78%	0.78	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-66	136.7	172.2	-73	166.5	0	0	0	110	L577 R581	L577-L579 PolarHBondContact O-N 3.3Å; L579-R581 PolarHBondContact O-N 3.1Å
580	P	31.4	Very low	36	Very low	122 Å²	122	145.6 Å²	145.6	79%	0.792	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-64.5	125.6	171.7	24.8	-29.4	0	0	0	110
581	R	32.9	Very low	35.3	Very low	258 Å²	258	143.1 Å²	143.1	97%	0.974	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-71.2	124.2	169.6	-70.5	-180	179.9	175.5	-1.6	108.8	L579	L579-R581 PolarHBondContact O-N 3.1Å
582	G	32	Very low	34.9	Very low	70 Å²	70	148.1 Å²	148.1	72%	0.722	75%	0.753	S	S	*	*			trans	134	77.3	166.5	0	0	0	0	0	115
583	F	28.9	Very low	34.3	Very low	178 Å²	178	145 Å²	145	78%	0.781	76%	0.761	S	S	*	*			trans	-156.2	96.4	143.5	-141.3	-100.6	0	0	0	107.6	E585	F583-E585 HydrophobicContact CD1-CB 4.12Å; F583-E585 HydrophobicContact CE1-CB 3.88Å; F583-E585 WeakPolarHBondContact CE1-OE2 3.45Å
584	V	28.8	Very low	34.1	Very low	146 Å²	146	141.1 Å²	141.1	89%	0.885	77%	0.766	S	S	*	*			trans	-98.6	110.8	163.6	174.9	0	0	0	0	103.9
585	E	31.8	Very low	34.2	Very low	147 Å²	147	146.6 Å²	146.6	69%	0.687	79%	0.787	S	S	*	*			trans	-130.3	113.4	165.1	-154.9	157.9	-142.2	0	0	108.7	F583	F583-E585 HydrophobicContact CD1-CB 4.12Å; F583-E585 HydrophobicContact CE1-CB 3.88Å; F583-E585 WeakPolarHBondContact CE1-OE2 3.45Å
586	S	28.6	Very low	34.6	Very low	99 Å²	99	145 Å²	145	69%	0.692	79%	0.79	S	S	*	*			trans	-80.8	126.4	-177.3	45	0	0	0	0	110.8
587	H	34.4	Very low	34.8	Very low	181 Å²	181	145.9 Å²	145.9	84%	0.838	80%	0.8	S	S	*	*			trans	-132	106.7	155.2	-91.8	-78.7	0	0	0	110.4
588	K	30.3	Very low	35.2	Very low	206 Å²	206	145 Å²	145	90%	0.896	80%	0.801	S	S	*	*			trans	-61.3	138.9	163.6	-85.3	176.1	169.2	-176.7	0	110
589	V	35.3	Very low	35.4	Very low	134 Å²	134	140.7 Å²	140.7	81%	0.812	80%	0.796	S	S	*	*			trans	-127.9	135.9	157	179.3	0	0	0	0	106.7
590	P	34.8	Very low	35.9	Very low	105 Å²	105	138 Å²	138	68%	0.682	79%	0.789	S	S	*	*			trans	-87.7	166.6	-157	36.4	-35.3	0	0	0	113.5
591	P	32	Very low	36.5	Very low	129 Å²	129	140 Å²	140	84%	0.838	79%	0.788	S	S	*	*			trans	-83.5	145.1	173.5	34.7	-30.4	0	0	0	110.8
592	K	45.2	Very low	37.1	Very low	205 Å²	205	133.1 Å²	133.1	89%	0.891	77%	0.77	S	S	*	*			trans	-128.2	122.3	161.5	-84	-170.7	175.7	-177	0	109.9
593	S	40.6	Very low	37.7	Very low	125 Å²	125	137 Å²	137	87%	0.874	77%	0.774	S	S	*	*			trans	-63.1	153.5	173	47.5	0	0	0	0	113.9
594	G	39.6	Very low	38.4	Very low	78 Å²	78	132 Å²	132	80%	0.804	77%	0.773	S	S	*	*			trans	156.8	76.1	162.1	0	0	0	0	0	114.2
595	E	36.9	Very low	39.4	Very low	189 Å²	189	132.2 Å²	132.2	88%	0.883	77%	0.77	S	S	*	*			trans	-62.2	-176.3	157.9	-66.7	-174.7	147.6	0	0	111.4
596	P	44.4	Very low	40.1	Very low	103 Å²	103	129.8 Å²	129.8	67%	0.669	77%	0.769	S	S	*	*			cis	-140.7	172.7	2.9	24.7	1	0	0	0	116.9
597	S	41.3	Very low	41.6	Very low	99 Å²	99	135.7 Å²	135.7	69%	0.692	80%	0.801	S	S	*	*			trans	59.4	130.4	141.2	63.5	0	0	0	0	118.8
598	T	40.8	Very low	41.9	Very low	122 Å²	122	133.4 Å²	133.4	75%	0.748	80%	0.799	S	S	*	*				-162.3	138.7	59.3	45.5	0	0	0	0	112.6
599	S	41.8	Very low	42.6	Very low	110 Å²	110	129.6 Å²	129.6	77%	0.769	79%	0.794	S	S	*	*			trans	32.2	134.2	141.8	60.7	0	0	0	0	119.8
600	S	42.8	Very low	43	Very low	91 Å²	91	129.3 Å²	129.3	64%	0.636	79%	0.793	S	S	*	*				-172.9	139.7	55.9	48.3	0	0	0	0	112.3
601	E	43.3	Very low	43.4	Very low	165 Å²	165	130.8 Å²	130.8	77%	0.771	80%	0.8	S	S	*	*			trans	62.2	143.9	137	-62.7	-177.8	131.7	0	0	119.9
602	N	45.9	Very low	44.2	Very low	114 Å²	114	130.9 Å²	130.9	61%	0.61	80%	0.797	S	S	*	*			cis	-167.4	139.3	-4.1	-112.5	-25.2	0	0	0	108.4
603	N	43.7	Very low	44.1	Very low	150 Å²	150	125.9 Å²	125.9	80%	0.802	79%	0.791	S	S	*	*			trans	63.8	130	133.8	-64.3	-23.7	0	0	0	125.3
604	G	44.3	Very low	44.3	Very low	74 Å²	74	126 Å²	126	76%	0.763	79%	0.785	S	S	*	*			trans	111.5	128.4	141.4	0	0	0	0	0	113.8
605	N	50	Low	44.7	Very low	150 Å²	150	129.7 Å²	129.7	80%	0.802	78%	0.784	S	S	*	*			cis	-169.3	131.5	7.4	-142.9	-1.2	0	0	0	107.8
606	S	47	Very low	45.3	Very low	96 Å²	96	124.8 Å²	124.8	67%	0.671	78%	0.775	S	S	*	*			trans	54.3	128.7	131.3	-57.7	0	0	0	0	122.7
607	T	58.9	Low	45.4	Very low	223 Å²	223	126.7 Å²	126.7	100%	1.368	79%	0.785	S	S	*	*			trans	73.4	0	164.2	52.3	0	0	0	0	119.7

Retrieved 607 of 607 residues in 423.2 ms (Link to these results)

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