A0A077ZKW2_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZKW2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 633 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	47.2	Very low	39.3	Very low	250 Å²	250	155.6 Å²	155.6	100%	1.232	88%	0.881	S	S	*	*				0	113.8	0	-68.2	-174	-179.1	0	0	105.7
2	E	33	Very low	39.3	Very low	191 Å²	191	157.3 Å²	157.3	89%	0.893	89%	0.885	S	S	*	*			trans	-142.9	151.6	-146.9	-175.7	175.9	-159.9	0	0	110.4
3	A	36.1	Very low	39.2	Very low	89 Å²	89	155.2 Å²	155.2	74%	0.736	88%	0.877	S	S	*	*			trans	66	130.1	170.9	0	0	0	0	0	118.6
4	V	40.9	Very low	39.1	Very low	147 Å²	147	152.8 Å²	152.8	89%	0.891	86%	0.861	S	S	*	*				161.5	95.5	111.9	166.3	0	0	0	0	108
5	A	40.3	Very low	39.2	Very low	96 Å²	96	150.6 Å²	150.6	79%	0.793	85%	0.852	S	S	*	*			trans	-172.1	66.5	166.1	0	0	0	0	0	112
6	S	39.1	Very low	39.3	Very low	125 Å²	125	150.8 Å²	150.8	87%	0.874	84%	0.843	S	S	*	*			trans	-172.5	70.2	168.3	-84	0	0	0	0	112.7
7	R	36.3	Very low	39.1	Very low	239 Å²	239	146.8 Å²	146.8	90%	0.902	83%	0.834	S	S	*	*			trans	-152.5	103.7	161.5	-72.7	-165.3	178.4	170.1	-0.4	109.2
8	N	40.9	Very low	39	Very low	170 Å²	170	145.9 Å²	145.9	91%	0.909	83%	0.827	S	S	*	*			trans	-178.2	78.9	160.3	-95.3	-11.1	0	0	0	108.9
9	A	37.5	Very low	39.2	Very low	102 Å²	102	142.5 Å²	142.5	84%	0.843	81%	0.805	S	S	*	*			trans	-159.5	81	169.1	0	0	0	0	0	107.5
10	E	42.8	Very low	39.2	Very low	189 Å²	189	140.5 Å²	140.5	88%	0.883	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-92.9	147.1	175.9	-68.1	-159	163.4	0	0	111
11	P	37.9	Very low	39.7	Very low	114 Å²	114	138.7 Å²	138.7	74%	0.74	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-79.6	147.7	-169.7	31.9	-35.6	0	0	0	113	V13	P11-V13 PolarHBondContact O-N 3.38Å
12	L	39.2	Very low	40.2	Very low	176 Å²	176	128.9 Å²	128.9	92%	0.921	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-55.7	127.5	172.7	-77.6	159.4	0	0	0	111.3	N14	L12-N14 PolarHBondContact O-N 3.29Å
13	V	38.6	Very low	41.6	Very low	130 Å²	130	125.7 Å²	125.7	79%	0.788	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-63.9	132	177	177.1	0	0	0	0	110	P11 V15	P11-V13 PolarHBondContact O-N 3.38Å; V13-V15 PolarHBondContact O-N 3Å
14	N	37.1	Very low	43.9	Very low	121 Å²	121	126.5 Å²	126.5	65%	0.647	71%	0.709	S	S	*	*			trans	-76.4	84.8	-171.5	-167.9	-3.6	0	0	0	112.3	L12 H16 A17	L12-N14 PolarHBondContact O-N 3.29Å; N14-H16 PolarHBondContact O-N 3.48Å; N14-H16 VanDerWaalsContact O-N 3.11Å; N14-A17 PolarHBondContact O-N 2.75Å
15	V	41.7	Very low	46.3	Very low	120 Å²	120	121 Å²	121	73%	0.727	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-60	-19.4	-179.4	-178.7	0	0	0	0	113.1	V13 A17	V13-V15 PolarHBondContact O-N 3Å; V15-A17 VanDerWaalsContact C-N 3.28Å; V15-A17 PolarHBondContact O-N 2.86Å
16	H	40.3	Very low	48.8	Very low	153 Å²	153	120.2 Å²	120.2	71%	0.708	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-67.7	-19.7	-177.4	-97.8	-80.9	0	0	0	115.3	N14 N18	N14-H16 PolarHBondContact O-N 3.48Å; N14-H16 VanDerWaalsContact O-N 3.11Å; H16-N18 VanDerWaalsContact C-N 3.27Å; H16-N18 PolarHBondContact O-N 3.09Å
17	A	35.3	Very low	51.4	Low	84 Å²	84	118.2 Å²	118.2	69%	0.694	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-70	-16.3	-170.2	0	0	0	0	0	115.2	N14 V15	N14-A17 PolarHBondContact O-N 2.75Å; V15-A17 VanDerWaalsContact C-N 3.28Å; V15-A17 PolarHBondContact O-N 2.86Å
18	N	38.7	Very low	54.1	Low	131 Å²	131	108.6 Å²	108.6	70%	0.701	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-109.3	12.1	-175	-87.4	-22.4	0	0	0	114.4	H16 W21	H16-N18 VanDerWaalsContact C-N 3.27Å; H16-N18 PolarHBondContact O-N 3.09Å; N18-W21 PolarHBondContact O-NE1 3.32Å
19	L	41.4	Very low	56.7	Low	80 Å²	80	104.4 Å²	104.4	42%	0.419	57%	0.571	S	S	.	*			trans	-91.7	6.6	-170.3	-69.4	170.8	0	0	0	116.3	W21 V22	L19-W21 VanDerWaalsContact C-N 3.3Å; L19-W21 PolarHBondContact O-N 3.14Å; L19-V22 HydrophobicContact CD2-CB 4.16Å; L19-V22 HydrophobicContact CD2-CG2 3.6Å; L19-V22 WeakPolarHBondContact O-CB 3.33Å; L19-V22 PolarHBondContact O-N 3.33Å
20	S	40.7	Very low	59.4	Low	102 Å²	102	103.5 Å²	103.5	71%	0.713	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-61.9	-32.9	-175.7	57.5	0	0	0	0	114.3	V22	S20-V22 VanDerWaalsContact C-N 3.32Å
21	W	49.9	Very low	61.9	Low	104 Å²	104	96.8 Å²	96.8	39%	0.394	53%	0.529	S	S	.	.	G	3₁₀ helix	trans	-73.8	-21.7	174.8	57.3	-68.1	0	0	0	113.2	N18 L19 Q23 H24 F25 W53 W65	N18-W21 PolarHBondContact O-NE1 3.32Å; L19-W21 VanDerWaalsContact C-N 3.3Å; L19-W21 PolarHBondContact O-N 3.14Å; W21-Q23 PolarHBondContact O-N 3.47Å; W21-H24 PolarHBondContact O-N 3.37Å; W21-F25 HydrophobicContact CE3-CD2 4.47Å; W21-F25 AromaticContact CE3-CE2 3.8Å; W21-F25 HydrophobicContact CE3-CE2 3.8Å; W21-F25 HydrophobicContact CE3-CZ 4.41Å; W21-F25 HydrophobicContact CZ3-CE2 4.38Å; W21-F25 VanDerWaalsContact O-CD2 3.3Å; W21-F25 WeakPolarHBondContact O-CD2 3.47Å; W21-W53 AromaticContact CH2-CD2 3.92Å; W21-W53 HydrophobicContact CH2-CD2 3.92Å; W21-W53 AromaticContact CH2-CE2 3.44Å; W21-W53 VanDerWaalsContact CH2-CE2 3.44Å; W21-W53 HydrophobicContact CH2-CE3 4.48Å; W21-W53 HydrophobicContact CH2-CG 4.41Å; W21-W53 HydrophobicContact CH2-CH2 4.17Å; W21-W53 AromaticContact CH2-CZ2 3.58Å; W21-W53 HydrophobicContact CH2-CZ2 3.58Å; W21-W53 AromaticContact CH2-NE1 3.66Å; W21-W53 HydrophobicContact CZ2-CZ2 4.28Å; W21-W53 HydrophobicContact CZ3-CD2 4.24Å; W21-W53 HydrophobicContact CZ3-CE3 4.4Å; W21-W53 HydrophobicContact CZ3-CH2 4.32Å; W21-W53 HydrophobicContact CZ3-CZ2 4.17Å; W21-W53 HydrophobicContact CZ3-CZ3 4.44Å; W21-W65 HydrophobicContact CZ3-CZ3 4.19Å
22	V	56	Low	64.5	Low	43 Å²	43	98.4 Å²	98.4	26%	0.261	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-69.7	-15.2	-179.5	-178.7	0	0	0	0	112.3	L19 S20 H24 F25	L19-V22 HydrophobicContact CD2-CB 4.16Å; L19-V22 HydrophobicContact CD2-CG2 3.6Å; L19-V22 WeakPolarHBondContact O-CB 3.33Å; L19-V22 PolarHBondContact O-N 3.33Å; S20-V22 VanDerWaalsContact C-N 3.32Å; V22-H24 PolarHBondContact O-N 3.31Å; V22-H24 VanDerWaalsContact O-N 3.09Å; V22-F25 PolarHBondContact O-N 2.69Å
23	Q	63.8	Low	67.1	Low	124 Å²	124	91.3 Å²	91.3	58%	0.579	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-59.7	-21.8	175.7	-165.8	168.7	2.3	0	0	113.8	W21	W21-Q23 PolarHBondContact O-N 3.47Å
24	H	83.3	Confident	69.9	Low	106 Å²	106	88.9 Å²	88.9	49%	0.491	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-94.7	-4.4	175.4	-66.2	-64.2	0	0	0	114.7	W21 V22 D39 V40	W21-H24 PolarHBondContact O-N 3.37Å; V22-H24 PolarHBondContact O-N 3.31Å; V22-H24 VanDerWaalsContact O-N 3.09Å; H24-D39 WeakPolarHBondContact O-CA 3.49Å; H24-V40 PolarHBondContact O-N 3.08Å
25	F	90.8	Very high	72.7	Confident	33 Å²	33	85.1 Å²	85.1	15%	0.145	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	117.3	-177.1	-67.5	-87.3	0	0	0	111.6	W21 V22 Y37 D39 Y45 W65	W21-F25 HydrophobicContact CE3-CD2 4.47Å; W21-F25 AromaticContact CE3-CE2 3.8Å; W21-F25 HydrophobicContact CE3-CE2 3.8Å; W21-F25 HydrophobicContact CE3-CZ 4.41Å; W21-F25 HydrophobicContact CZ3-CE2 4.38Å; W21-F25 VanDerWaalsContact O-CD2 3.3Å; W21-F25 WeakPolarHBondContact O-CD2 3.47Å; V22-F25 PolarHBondContact O-N 2.69Å; F25-Y37 HydrophobicContact CB-CD1 4.14Å; F25-Y37 HydrophobicContact CB-CG 4.48Å; F25-D39 HydrophobicContact CD1-CB 4.37Å; F25-D39 HydrophobicContact CE1-CB 4.33Å; F25-Y45 HydrophobicContact CD1-CD2 4.02Å; F25-Y45 HydrophobicContact CD1-CE2 4.41Å; F25-Y45 HydrophobicContact CD1-CG 4.27Å; F25-Y45 AromaticContact CE1-CD1 3.87Å; F25-Y45 HydrophobicContact CE1-CD1 3.87Å; F25-Y45 AromaticContact CE1-CD2 3.54Å; F25-Y45 HydrophobicContact CE1-CD2 3.54Å; F25-Y45 AromaticContact CE1-CE1 3.96Å; F25-Y45 HydrophobicContact CE1-CE1 3.96Å; F25-Y45 AromaticContact CE1-CE2 3.68Å; F25-Y45 HydrophobicContact CE1-CE2 3.68Å; F25-Y45 AromaticContact CE1-CG 3.66Å; F25-Y45 HydrophobicContact CE1-CG 3.66Å; F25-Y45 AromaticContact CE1-CZ 3.89Å; F25-Y45 HydrophobicContact CZ-CE1 4.36Å; F25-W65 HydrophobicContact CZ-CZ3 4.49Å
26	K	93.1	Very high	75.4	Confident	78 Å²	78	81.1 Å²	81.1	34%	0.339	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.9	169.3	174.3	174.3	167.4	172.3	0	110.1	S28 Y37 T38 N207	K26-S28 PolarHBondContact O-N 3.45Å; K26-Y37 CarbonylContact O-C 3.57Å; K26-Y37 WeakPolarHBondContact O-CA 3.45Å; K26-T38 PolarHBondContact N-O 3.29Å; K26-T38 PolarHBondContact O-N 2.96Å; K26-T38 PolarHBondContact O-OG1 3.27Å; K26-N207 WeakPolarHBondContact CD-O 3.4Å; K26-N207 WeakPolarHBondContact CE-O 3.25Å; K26-N207 VanDerWaalsContact NZ-C 3.26Å; K26-N207 PolarHBondContact NZ-O 3.18Å
27	F	94.6	Very high	78.1	Confident	84 Å²	84	75.3 Å²	75.3	37%	0.368	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	137.1	168.2	177.6	-100.5	0	0	0	111.1	H29 T30 N35 Y37	F27-H29 VanDerWaalsContact CZ-C 3.48Å; F27-T30 WeakPolarHBondContact CZ-OG1 3.44Å; F27-N35 HydrophobicContact CE2-CB 4.4Å; F27-Y37 HydrophobicContact CB-CD1 4.18Å; F27-Y37 HydrophobicContact CB-CE1 4.03Å; F27-Y37 HydrophobicContact CD2-CD1 4.43Å; F27-Y37 AromaticContact CD2-CE1 3.88Å; F27-Y37 HydrophobicContact CD2-CE1 3.88Å; F27-Y37 HydrophobicContact CG-CE1 4.47Å
28	S	93.1	Very high	81	Confident	37 Å²	37	72.3 Å²	72.3	26%	0.259	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-59.4	-176.8	-59.1	0	0	0	0	112.1	K26 Y36 T38	K26-S28 PolarHBondContact O-N 3.45Å; S28-Y36 WeakPolarHBondContact CB-O 3.44Å; S28-Y36 PolarHBondContact N-O 2.85Å; S28-T38 PolarHBondContact OG-OG1 3.22Å
29	H	94.1	Very high	83.7	Confident	82 Å²	82	67.4 Å²	67.4	38%	0.38	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.2	173.5	177.4	65.7	-76.3	0	0	0	110.7	F27 Y36	F27-H29 VanDerWaalsContact CZ-C 3.48Å; H29-Y36 AromaticContact CD2-CD2 3.86Å; H29-Y36 AromaticContact CE1-CD2 3.82Å; H29-Y36 AromaticContact CE1-CG 3.85Å; H29-Y36 AromaticContact NE2-CD2 3.51Å; H29-Y36 AromaticContact NE2-CE2 3.91Å; H29-Y36 AromaticContact NE2-CG 4Å; H29-Y36 WeakPolarHBondContact O-CB 3.38Å; H29-Y36 PolarHBondContact O-N 3.35Å
30	T	96	Very high	86.1	Confident	83 Å²	83	68.1 Å²	68.1	51%	0.509	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	137.4	171.6	-53.9	0	0	0	0	109.1	F27 Y34 N35	F27-T30 WeakPolarHBondContact CZ-OG1 3.44Å; T30-Y34 CarbonylContact C-O 3.6Å; T30-Y34 VanDerWaalsContact CA-O 3.31Å; T30-Y34 WeakPolarHBondContact CA-O 3.4Å; T30-Y34 WeakPolarHBondContact CG2-O 3.46Å; T30-N35 WeakPolarHBondContact CB-OD1 3.35Å; T30-N35 VanDerWaalsContact CG2-OD1 3.23Å; T30-N35 WeakPolarHBondContact CG2-OD1 3.4Å; T30-N35 PolarHBondContact OG1-OD1 2.99Å
31	S	94.6	Very high	88.6	Confident	48 Å²	48	67.8 Å²	67.8	34%	0.336	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	143.9	175.5	-174.7	0	0	0	0	111.1	G33 Y34	S31-G33 VanDerWaalsContact C-N 3.26Å; S31-G33 PolarHBondContact O-N 3.06Å; S31-G33 VanDerWaalsContact O-N 3.13Å; S31-Y34 PolarHBondContact N-O 3.13Å; S31-Y34 WeakPolarHBondContact O-CB 3.36Å; S31-Y34 PolarHBondContact O-N 2.91Å
32	N	93.1	Very high	90.6	Very high	147 Å²	147	65 Å²	65	79%	0.786	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	32.1	175.4	-61.6	-26.5	0	0	0	116	Y34	N32-Y34 VanDerWaalsContact C-N 3.34Å; N32-Y34 HydrophobicContact CB-CD2 4.38Å; N32-Y34 VanDerWaalsContact O-CD2 3.24Å; N32-Y34 WeakPolarHBondContact O-CD2 3.3Å; N32-Y34 WeakPolarHBondContact O-CE2 3.45Å
33	G	93.6	Very high	92.4	Very high	28 Å²	28	70 Å²	70	29%	0.289	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	12.2	-176	0	0	0	0	0	114.5	S31 E49	S31-G33 VanDerWaalsContact C-N 3.26Å; S31-G33 PolarHBondContact O-N 3.06Å; S31-G33 VanDerWaalsContact O-N 3.13Å; G33-E49 PolarHBondContact O-N 3.07Å
34	Y	96.7	Very high	94	Very high	78 Å²	78	69.2 Å²	69.2	31%	0.306	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.1	176.2	-62.5	-91.4	0	0	0	111.8	T30 S31 N32 A46 H47 D48 Y54	T30-Y34 CarbonylContact C-O 3.6Å; T30-Y34 VanDerWaalsContact CA-O 3.31Å; T30-Y34 WeakPolarHBondContact CA-O 3.4Å; T30-Y34 WeakPolarHBondContact CG2-O 3.46Å; S31-Y34 PolarHBondContact N-O 3.13Å; S31-Y34 WeakPolarHBondContact O-CB 3.36Å; S31-Y34 PolarHBondContact O-N 2.91Å; N32-Y34 VanDerWaalsContact C-N 3.34Å; N32-Y34 HydrophobicContact CB-CD2 4.38Å; N32-Y34 VanDerWaalsContact O-CD2 3.24Å; N32-Y34 WeakPolarHBondContact O-CD2 3.3Å; N32-Y34 WeakPolarHBondContact O-CE2 3.45Å; Y34-A46 HydrophobicContact CD1-CB 4.31Å; Y34-H47 CarbonylContact C-O 3.57Å; Y34-H47 VanDerWaalsContact CA-O 3.24Å; Y34-H47 WeakPolarHBondContact CA-O 3.39Å; Y34-D48 HydrophobicContact CD1-CB 3.97Å; Y34-D48 HydrophobicContact CE1-CB 3.71Å; Y34-Y54 HydrophobicContact CD1-CD2 4.49Å; Y34-Y54 HydrophobicContact CD1-CE2 4.44Å; Y34-Y54 HydrophobicContact CE1-CD2 4.2Å; Y34-Y54 AromaticContact CE1-CE2 3.81Å; Y34-Y54 HydrophobicContact CE1-CE2 3.81Å
35	N	96.9	Very high	94.6	Very high	43 Å²	43	65 Å²	65	23%	0.23	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	124.7	168.5	-70.1	-48.1	0	0	0	109.6	F27 T30 Y37 A46 H47	F27-N35 HydrophobicContact CE2-CB 4.4Å; T30-N35 WeakPolarHBondContact CB-OD1 3.35Å; T30-N35 VanDerWaalsContact CG2-OD1 3.23Å; T30-N35 WeakPolarHBondContact CG2-OD1 3.4Å; T30-N35 PolarHBondContact OG1-OD1 2.99Å; N35-Y37 HydrophobicContact CB-CE2 3.66Å; N35-Y37 WeakPolarHBondContact O-CD2 3.3Å; N35-Y37 VanDerWaalsContact O-CE2 3.3Å; N35-Y37 WeakPolarHBondContact O-CE2 3.45Å; N35-A46 CarbonylContact O-C 3.54Å; N35-A46 VanDerWaalsContact O-CA 3.24Å; N35-A46 WeakPolarHBondContact O-CA 3.42Å; N35-H47 PolarHBondContact N-O 3.2Å; N35-H47 PolarHBondContact ND2-NE2 3.03Å; N35-H47 PolarHBondContact O-N 3.38Å
36	Y	97.1	Very high	94.9	Very high	36 Å²	36	63.4 Å²	63.4	14%	0.141	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	136.7	-175.4	-64.6	-89	0	0	0	112.5	S28 H29 Y45 A46 F62	S28-Y36 WeakPolarHBondContact CB-O 3.44Å; S28-Y36 PolarHBondContact N-O 2.85Å; H29-Y36 AromaticContact CD2-CD2 3.86Å; H29-Y36 AromaticContact CE1-CD2 3.82Å; H29-Y36 AromaticContact CE1-CG 3.85Å; H29-Y36 AromaticContact NE2-CD2 3.51Å; H29-Y36 AromaticContact NE2-CE2 3.91Å; H29-Y36 AromaticContact NE2-CG 4Å; H29-Y36 WeakPolarHBondContact O-CB 3.38Å; H29-Y36 PolarHBondContact O-N 3.35Å; Y36-Y45 CarbonylContact C-O 3.51Å; Y36-Y45 WeakPolarHBondContact CA-O 3.35Å; Y36-A46 HydrophobicContact CD1-CB 3.8Å; Y36-A46 HydrophobicContact CE1-CB 3.78Å; Y36-F62 HydrophobicContact CD1-CE1 4.33Å; Y36-F62 HydrophobicContact CD1-CE2 4.35Å; Y36-F62 AromaticContact CD1-CZ 3.83Å; Y36-F62 HydrophobicContact CD1-CZ 3.83Å; Y36-F62 HydrophobicContact CE1-CD2 4.46Å; Y36-F62 HydrophobicContact CE1-CE1 4.34Å; Y36-F62 AromaticContact CE1-CE2 3.81Å; Y36-F62 HydrophobicContact CE1-CE2 3.81Å; Y36-F62 AromaticContact CE1-CZ 3.74Å; Y36-F62 HydrophobicContact CE1-CZ 3.74Å
37	Y	97.4	Very high	95	Very high	31 Å²	31	61.3 Å²	61.3	12%	0.122	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	153.7	-178.3	-57.2	-95	0	0	0	110.7	F25 K26 F27 N35 Y44 Y45 H47 W53	F25-Y37 HydrophobicContact CB-CD1 4.14Å; F25-Y37 HydrophobicContact CB-CG 4.48Å; K26-Y37 CarbonylContact O-C 3.57Å; K26-Y37 WeakPolarHBondContact O-CA 3.45Å; F27-Y37 HydrophobicContact CB-CD1 4.18Å; F27-Y37 HydrophobicContact CB-CE1 4.03Å; F27-Y37 HydrophobicContact CD2-CD1 4.43Å; F27-Y37 AromaticContact CD2-CE1 3.88Å; F27-Y37 HydrophobicContact CD2-CE1 3.88Å; F27-Y37 HydrophobicContact CG-CE1 4.47Å; N35-Y37 HydrophobicContact CB-CE2 3.66Å; N35-Y37 WeakPolarHBondContact O-CD2 3.3Å; N35-Y37 VanDerWaalsContact O-CE2 3.3Å; N35-Y37 WeakPolarHBondContact O-CE2 3.45Å; Y37-Y44 WeakPolarHBondContact O-CA 3.38Å; Y37-Y45 PolarHBondContact N-O 3.11Å; Y37-Y45 PolarHBondContact O-N 2.94Å; Y37-H47 AromaticContact CE2-CE1 3.71Å; Y37-H47 AromaticContact CE2-ND1 3.36Å; Y37-H47 WeakPolarHBondContact CE2-ND1 3.26Å; Y37-H47 AromaticContact CZ-CE1 3.79Å; Y37-H47 AromaticContact CZ-ND1 3.86Å; Y37-H47 PolarHBondContact OH-CE1 3.49Å; Y37-W53 HydrophobicContact CD2-CH2 4.1Å; Y37-W53 AromaticContact CD2-CZ3 3.85Å; Y37-W53 HydrophobicContact CD2-CZ3 3.85Å; Y37-W53 AromaticContact CE2-CH2 3.97Å; Y37-W53 HydrophobicContact CE2-CH2 3.97Å; Y37-W53 HydrophobicContact CE2-CZ3 4.15Å; Y37-W53 HydrophobicContact CG-CZ3 4.43Å
38	T	96.2	Very high	95.1	Very high	21 Å²	21	58.3 Å²	58.3	13%	0.129	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	133.1	168.2	41.3	0	0	0	0	108.9	K26 S28 R43 Y44	K26-T38 PolarHBondContact N-O 3.29Å; K26-T38 PolarHBondContact O-N 2.96Å; K26-T38 PolarHBondContact O-OG1 3.27Å; S28-T38 PolarHBondContact OG-OG1 3.22Å; T38-R43 WeakPolarHBondContact CA-O 3.24Å; T38-Y44 HydrophobicContact CG2-CD1 3.52Å; T38-Y44 HydrophobicContact CG2-CD2 4.38Å; T38-Y44 HydrophobicContact CG2-CE1 3.36Å; T38-Y44 HydrophobicContact CG2-CE2 4.24Å; T38-Y44 HydrophobicContact CG2-CG 4.04Å
39	D	94.5	Very high	95.1	Very high	27 Å²	27	65 Å²	65	14%	0.144	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-179.5	174.4	78.7	-17.3	0	0	0	111.9	H24 F25 T41 G42 R43 Y45	H24-D39 WeakPolarHBondContact O-CA 3.49Å; F25-D39 HydrophobicContact CD1-CB 4.37Å; F25-D39 HydrophobicContact CE1-CB 4.33Å; D39-T41 VanDerWaalsContact CG-N 3.32Å; D39-T41 PolarHBondContact O-N 3.48Å; D39-T41 WeakPolarHBondContact OD1-CA 3.42Å; D39-T41 PolarHBondContact OD1-N 3.17Å; D39-T41 PolarHBondContact OD1-OG1 3.3Å; D39-T41 WeakPolarHBondContact OD2-CB 3.4Å; D39-T41 WeakPolarHBondContact OD2-CG2 3.34Å; D39-T41 PolarHBondContact OD2-OG1 3.17Å; D39-G42 PolarHBondContact O-N 3.42Å; D39-G42 PolarHBondContact OD1-N 3.43Å; D39-R43 PolarHBondContact N-O 3.06Å; D39-R43 VanDerWaalsContact N-O 3.08Å; D39-R43 PolarHBondContact OD1-N 2.95Å; D39-Y45 HydrophobicContact CB-CD2 4.49Å; D39-Y45 HydrophobicContact CB-CE2 3.8Å
40	V	93	Very high	95.1	Very high	95 Å²	95	64.8 Å²	64.8	58%	0.576	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-15	173.3	-63.6	0	0	0	0	114.3	H24	H24-V40 PolarHBondContact O-N 3.08Å
41	T	92.5	Very high	95	Very high	96 Å²	96	63.1 Å²	63.1	59%	0.589	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-9.3	177.2	78.4	0	0	0	0	113.4	D39 R43	D39-T41 VanDerWaalsContact CG-N 3.32Å; D39-T41 PolarHBondContact O-N 3.48Å; D39-T41 WeakPolarHBondContact OD1-CA 3.42Å; D39-T41 PolarHBondContact OD1-N 3.17Å; D39-T41 PolarHBondContact OD1-OG1 3.3Å; D39-T41 WeakPolarHBondContact OD2-CB 3.4Å; D39-T41 WeakPolarHBondContact OD2-CG2 3.34Å; D39-T41 PolarHBondContact OD2-OG1 3.17Å; T41-R43 WeakPolarHBondContact OG1-CD 3.04Å; T41-R43 WeakPolarHBondContact OG1-CG 3.4Å
42	G	92.9	Very high	95	Very high	46 Å²	46	66 Å²	66	47%	0.474	36%	0.359	S	S	.	.			trans	87	10	-176.9	0	0	0	0	0	114.3	D39	D39-G42 PolarHBondContact O-N 3.42Å; D39-G42 PolarHBondContact OD1-N 3.43Å
43	R	93.7	Very high	95.2	Very high	148 Å²	148	61.2 Å²	61.2	56%	0.558	33%	0.33	S	S	*	.			trans	-73.3	139.8	171.6	-70.2	171.5	-179.5	-164.3	-1.2	110	T38 D39 T41 Y45	T38-R43 WeakPolarHBondContact CA-O 3.24Å; D39-R43 PolarHBondContact N-O 3.06Å; D39-R43 VanDerWaalsContact N-O 3.08Å; D39-R43 PolarHBondContact OD1-N 2.95Å; T41-R43 WeakPolarHBondContact OG1-CD 3.04Å; T41-R43 WeakPolarHBondContact OG1-CG 3.4Å; R43-Y45 HydrophobicContact CB-CD2 4.46Å; R43-Y45 HydrophobicContact CB-CE2 3.63Å; R43-Y45 WeakPolarHBondContact O-CD2 3.46Å; R43-Y45 WeakPolarHBondContact O-CE2 3.47Å
44	Y	95.9	Very high	95.3	Very high	106 Å²	106	61.8 Å²	61.8	42%	0.416	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	139.9	176.6	-70.8	-97	0	0	0	111.4	Y37 T38 Q56	Y37-Y44 WeakPolarHBondContact O-CA 3.38Å; T38-Y44 HydrophobicContact CG2-CD1 3.52Å; T38-Y44 HydrophobicContact CG2-CD2 4.38Å; T38-Y44 HydrophobicContact CG2-CE1 3.36Å; T38-Y44 HydrophobicContact CG2-CE2 4.24Å; T38-Y44 HydrophobicContact CG2-CG 4.04Å; Y44-Q56 VanDerWaalsContact CD2-OE1 3.27Å; Y44-Q56 WeakPolarHBondContact O-CB 3.42Å; Y44-Q56 PolarHBondContact O-N 3.25Å
45	Y	97.3	Very high	95.4	Very high	17 Å²	17	60.3 Å²	60.3	7%	0.067	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	152.7	176	-60.7	-104.4	0	0	0	108.8	F25 Y36 Y37 D39 R43 Y54 I55 W65	F25-Y45 HydrophobicContact CD1-CD2 4.02Å; F25-Y45 HydrophobicContact CD1-CE2 4.41Å; F25-Y45 HydrophobicContact CD1-CG 4.27Å; F25-Y45 AromaticContact CE1-CD1 3.87Å; F25-Y45 HydrophobicContact CE1-CD1 3.87Å; F25-Y45 AromaticContact CE1-CD2 3.54Å; F25-Y45 HydrophobicContact CE1-CD2 3.54Å; F25-Y45 AromaticContact CE1-CE1 3.96Å; F25-Y45 HydrophobicContact CE1-CE1 3.96Å; F25-Y45 AromaticContact CE1-CE2 3.68Å; F25-Y45 HydrophobicContact CE1-CE2 3.68Å; F25-Y45 AromaticContact CE1-CG 3.66Å; F25-Y45 HydrophobicContact CE1-CG 3.66Å; F25-Y45 AromaticContact CE1-CZ 3.89Å; F25-Y45 HydrophobicContact CZ-CE1 4.36Å; Y36-Y45 CarbonylContact C-O 3.51Å; Y36-Y45 WeakPolarHBondContact CA-O 3.35Å; Y37-Y45 PolarHBondContact N-O 3.11Å; Y37-Y45 PolarHBondContact O-N 2.94Å; D39-Y45 HydrophobicContact CB-CD2 4.49Å; D39-Y45 HydrophobicContact CB-CE2 3.8Å; R43-Y45 HydrophobicContact CB-CD2 4.46Å; R43-Y45 HydrophobicContact CB-CE2 3.63Å; R43-Y45 WeakPolarHBondContact O-CD2 3.46Å; R43-Y45 WeakPolarHBondContact O-CE2 3.47Å; Y45-Y54 CarbonylContact C-O 3.54Å; Y45-Y54 VanDerWaalsContact CA-O 3.23Å; Y45-Y54 WeakPolarHBondContact CA-O 3.49Å; Y45-I55 HydrophobicContact CD1-CB 4.22Å; Y45-I55 HydrophobicContact CD1-CG1 4.13Å; Y45-I55 HydrophobicContact CE1-CB 4.21Å; Y45-I55 HydrophobicContact CE1-CD1 3.71Å; Y45-I55 HydrophobicContact CE1-CG1 3.79Å; Y45-W65 HydrophobicContact CD1-CE3 4.15Å; Y45-W65 HydrophobicContact CD1-CZ3 4.11Å; Y45-W65 HydrophobicContact CE1-CE3 4.23Å; Y45-W65 HydrophobicContact CE1-CH2 4.48Å; Y45-W65 HydrophobicContact CE1-CZ3 4.02Å
46	A	97.2	Very high	95.3	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.3	169.9	0	0	0	0	0	109.7	Y34 N35 Y36 W53 Y54 F62	Y34-A46 HydrophobicContact CD1-CB 4.31Å; N35-A46 CarbonylContact O-C 3.54Å; N35-A46 VanDerWaalsContact O-CA 3.24Å; N35-A46 WeakPolarHBondContact O-CA 3.42Å; Y36-A46 HydrophobicContact CD1-CB 3.8Å; Y36-A46 HydrophobicContact CE1-CB 3.78Å; A46-W53 CarbonylContact O-C 3.54Å; A46-W53 WeakPolarHBondContact O-CA 3.3Å; A46-Y54 PolarHBondContact N-O 3.35Å; A46-Y54 PolarHBondContact O-N 3Å; A46-F62 HydrophobicContact CB-CD1 3.92Å; A46-F62 HydrophobicContact CB-CE1 3.93Å
47	H	95.5	Very high	95.2	Very high	34 Å²	34	61.6 Å²	61.6	16%	0.157	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	146.4	160.6	75.8	-123.4	0	0	0	111.3	Y34 N35 Y37 K52 W53	Y34-H47 CarbonylContact C-O 3.57Å; Y34-H47 VanDerWaalsContact CA-O 3.24Å; Y34-H47 WeakPolarHBondContact CA-O 3.39Å; N35-H47 PolarHBondContact N-O 3.2Å; N35-H47 PolarHBondContact ND2-NE2 3.03Å; N35-H47 PolarHBondContact O-N 3.38Å; Y37-H47 AromaticContact CE2-CE1 3.71Å; Y37-H47 AromaticContact CE2-ND1 3.36Å; Y37-H47 WeakPolarHBondContact CE2-ND1 3.26Å; Y37-H47 AromaticContact CZ-CE1 3.79Å; Y37-H47 AromaticContact CZ-ND1 3.86Å; Y37-H47 PolarHBondContact OH-CE1 3.49Å; H47-K52 CarbonylContact C-O 3.58Å; H47-K52 WeakPolarHBondContact CA-O 3.46Å; H47-K52 WeakPolarHBondContact CB-O 3.47Å; H47-W53 HydrophobicContact CB-CD2 3.74Å; H47-W53 HydrophobicContact CB-CE3 4.07Å; H47-W53 HydrophobicContact CB-CG 4.14Å; H47-W53 HydrophobicContact CB-CH2 4.39Å; H47-W53 HydrophobicContact CB-CZ2 4.06Å; H47-W53 HydrophobicContact CB-CZ3 4.38Å; H47-W53 AromaticContact ND1-CE2 3.89Å; H47-W53 AromaticContact ND1-CH2 3.42Å; H47-W53 WeakPolarHBondContact ND1-CH2 3.45Å; H47-W53 AromaticContact ND1-CZ2 3.31Å; H47-W53 VanDerWaalsContact ND1-CZ2 3.31Å; H47-W53 WeakPolarHBondContact ND1-CZ2 3.37Å
48	D	95.9	Very high	95	Very high	21 Å²	21	65.6 Å²	65.6	11%	0.112	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	167.6	175.4	72.1	6.2	0	0	0	112.3	Y34 A50 G51 K52 Y54	Y34-D48 HydrophobicContact CD1-CB 3.97Å; Y34-D48 HydrophobicContact CE1-CB 3.71Å; D48-A50 PolarHBondContact O-N 3.24Å; D48-A50 VanDerWaalsContact O-N 3.09Å; D48-A50 VanDerWaalsContact OD1-C 3.26Å; D48-A50 WeakPolarHBondContact OD1-CA 3.45Å; D48-A50 WeakPolarHBondContact OD1-CB 3.42Å; D48-A50 PolarHBondContact OD1-N 3.27Å; D48-G51 PolarHBondContact O-N 3.26Å; D48-G51 PolarHBondContact OD1-N 2.95Å; D48-K52 PolarHBondContact N-O 3.46Å; D48-K52 WeakPolarHBondContact OD1-CB 3.41Å; D48-K52 PolarHBondContact OD1-N 3.36Å; D48-Y54 HydrophobicContact CB-CE2 4.23Å
49	E	93.6	Very high	95	Very high	176 Å²	176	72.5 Å²	72.5	82%	0.822	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-17.2	174.7	-68.9	172.2	-165.4	0	0	113.7	G33 G51	G33-E49 PolarHBondContact O-N 3.07Å; E49-G51 VanDerWaalsContact C-N 3.32Å
50	A	94.1	Very high	95	Very high	78 Å²	78	73.1 Å²	73.1	65%	0.645	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	1.3	174.3	0	0	0	0	0	113.4	D48 K52	D48-A50 PolarHBondContact O-N 3.24Å; D48-A50 VanDerWaalsContact O-N 3.09Å; D48-A50 VanDerWaalsContact OD1-C 3.26Å; D48-A50 WeakPolarHBondContact OD1-CA 3.45Å; D48-A50 WeakPolarHBondContact OD1-CB 3.42Å; D48-A50 PolarHBondContact OD1-N 3.27Å; A50-K52 VanDerWaalsContact C-N 3.34Å
51	G	93.1	Very high	95.1	Very high	48 Å²	48	75.6 Å²	75.6	50%	0.495	41%	0.407	S	S	.	.			trans	79.3	10.1	179.1	0	0	0	0	0	114.9	D48 E49 W53	D48-G51 PolarHBondContact O-N 3.26Å; D48-G51 PolarHBondContact OD1-N 2.95Å; E49-G51 VanDerWaalsContact C-N 3.32Å; G51-W53 VanDerWaalsContact O-CD1 3.29Å
52	K	95	Very high	95.2	Very high	108 Å²	108	74.5 Å²	74.5	47%	0.47	39%	0.394	S	S	.	.			trans	-77.7	135.9	174.2	-61.1	178.2	-173.6	166.8	0	109.9	H47 D48 A50 Y54 L64	H47-K52 CarbonylContact C-O 3.58Å; H47-K52 WeakPolarHBondContact CA-O 3.46Å; H47-K52 WeakPolarHBondContact CB-O 3.47Å; D48-K52 PolarHBondContact N-O 3.46Å; D48-K52 WeakPolarHBondContact OD1-CB 3.41Å; D48-K52 PolarHBondContact OD1-N 3.36Å; A50-K52 VanDerWaalsContact C-N 3.34Å; K52-Y54 HydrophobicContact CB-CE2 3.99Å; K52-L64 HydrophobicContact CB-CD1 3.87Å; K52-L64 HydrophobicContact CD-CD1 4.16Å; K52-L64 HydrophobicContact CG-CD1 4.41Å
53	W	96.7	Very high	95.3	Very high	48 Å²	48	75.6 Å²	75.6	18%	0.182	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	149.5	178.3	-71.8	76.1	0	0	0	111.6	W21 Y37 A46 H47 G51 W65	W21-W53 AromaticContact CH2-CD2 3.92Å; W21-W53 HydrophobicContact CH2-CD2 3.92Å; W21-W53 AromaticContact CH2-CE2 3.44Å; W21-W53 VanDerWaalsContact CH2-CE2 3.44Å; W21-W53 HydrophobicContact CH2-CE3 4.48Å; W21-W53 HydrophobicContact CH2-CG 4.41Å; W21-W53 HydrophobicContact CH2-CH2 4.17Å; W21-W53 AromaticContact CH2-CZ2 3.58Å; W21-W53 HydrophobicContact CH2-CZ2 3.58Å; W21-W53 AromaticContact CH2-NE1 3.66Å; W21-W53 HydrophobicContact CZ2-CZ2 4.28Å; W21-W53 HydrophobicContact CZ3-CD2 4.24Å; W21-W53 HydrophobicContact CZ3-CE3 4.4Å; W21-W53 HydrophobicContact CZ3-CH2 4.32Å; W21-W53 HydrophobicContact CZ3-CZ2 4.17Å; W21-W53 HydrophobicContact CZ3-CZ3 4.44Å; Y37-W53 HydrophobicContact CD2-CH2 4.1Å; Y37-W53 AromaticContact CD2-CZ3 3.85Å; Y37-W53 HydrophobicContact CD2-CZ3 3.85Å; Y37-W53 AromaticContact CE2-CH2 3.97Å; Y37-W53 HydrophobicContact CE2-CH2 3.97Å; Y37-W53 HydrophobicContact CE2-CZ3 4.15Å; Y37-W53 HydrophobicContact CG-CZ3 4.43Å; A46-W53 CarbonylContact O-C 3.54Å; A46-W53 WeakPolarHBondContact O-CA 3.3Å; H47-W53 HydrophobicContact CB-CD2 3.74Å; H47-W53 HydrophobicContact CB-CE3 4.07Å; H47-W53 HydrophobicContact CB-CG 4.14Å; H47-W53 HydrophobicContact CB-CH2 4.39Å; H47-W53 HydrophobicContact CB-CZ2 4.06Å; H47-W53 HydrophobicContact CB-CZ3 4.38Å; H47-W53 AromaticContact ND1-CE2 3.89Å; H47-W53 AromaticContact ND1-CH2 3.42Å; H47-W53 WeakPolarHBondContact ND1-CH2 3.45Å; H47-W53 AromaticContact ND1-CZ2 3.31Å; H47-W53 VanDerWaalsContact ND1-CZ2 3.31Å; H47-W53 WeakPolarHBondContact ND1-CZ2 3.37Å; G51-W53 VanDerWaalsContact O-CD1 3.29Å; W53-W65 HydrophobicContact CB-CB 4.27Å; W53-W65 HydrophobicContact CB-CE3 3.93Å; W53-W65 WeakPolarHBondContact O-CB 3.3Å; W53-W65 PolarHBondContact O-N 3.5Å
54	Y	97.3	Very high	95.5	Very high	40 Å²	40	72.3 Å²	72.3	16%	0.157	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141.9	179.6	-60.4	-102.3	0	0	0	109.1	Y34 Y45 A46 D48 K52 V63 L64	Y34-Y54 HydrophobicContact CD1-CD2 4.49Å; Y34-Y54 HydrophobicContact CD1-CE2 4.44Å; Y34-Y54 HydrophobicContact CE1-CD2 4.2Å; Y34-Y54 AromaticContact CE1-CE2 3.81Å; Y34-Y54 HydrophobicContact CE1-CE2 3.81Å; Y45-Y54 CarbonylContact C-O 3.54Å; Y45-Y54 VanDerWaalsContact CA-O 3.23Å; Y45-Y54 WeakPolarHBondContact CA-O 3.49Å; A46-Y54 PolarHBondContact N-O 3.35Å; A46-Y54 PolarHBondContact O-N 3Å; D48-Y54 HydrophobicContact CB-CE2 4.23Å; K52-Y54 HydrophobicContact CB-CE2 3.99Å; Y54-V63 CarbonylContact C-O 3.5Å; Y54-V63 WeakPolarHBondContact CA-O 3.35Å; Y54-L64 HydrophobicContact CD1-CB 4.29Å; Y54-L64 HydrophobicContact CD1-CD1 4.46Å; Y54-L64 HydrophobicContact CE1-CB 4.16Å; Y54-L64 HydrophobicContact CE1-CD1 4.01Å; Y54-L64 HydrophobicContact CE2-CD1 4.36Å
55	I	96.8	Very high	95.4	Very high	47 Å²	47	72.3 Å²	72.3	24%	0.241	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	141.3	174.1	-170.3	170	0	0	0	109.5	Y45 D57 F62 V63	Y45-I55 HydrophobicContact CD1-CB 4.22Å; Y45-I55 HydrophobicContact CD1-CG1 4.13Å; Y45-I55 HydrophobicContact CE1-CB 4.21Å; Y45-I55 HydrophobicContact CE1-CD1 3.71Å; Y45-I55 HydrophobicContact CE1-CG1 3.79Å; I55-D57 PolarHBondContact O-N 3.38Å; I55-F62 WeakPolarHBondContact O-CA 3.43Å; I55-V63 PolarHBondContact N-O 3.33Å; I55-V63 PolarHBondContact O-N 2.7Å
56	Q	96.5	Very high	94.8	Very high	66 Å²	66	74.6 Å²	74.6	31%	0.308	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	121.2	174.6	-164.8	177.4	40.2	0	0	110.4	Y44 G60 R61 F62	Y44-Q56 VanDerWaalsContact CD2-OE1 3.27Å; Y44-Q56 WeakPolarHBondContact O-CB 3.42Å; Y44-Q56 PolarHBondContact O-N 3.25Å; Q56-G60 VanDerWaalsContact CG-C 3.49Å; Q56-G60 PolarHBondContact NE2-O 3.49Å; Q56-R61 CarbonylContact C-O 3.59Å; Q56-R61 WeakPolarHBondContact CA-O 3.24Å; Q56-F62 HydrophobicContact CB-CD1 4.25Å; Q56-F62 HydrophobicContact CB-CE1 3.93Å; Q56-F62 HydrophobicContact CB-CZ 4.19Å; Q56-F62 HydrophobicContact CG-CZ 4.43Å
57	D	95	Very high	93.3	Very high	39 Å²	39	80 Å²	80	21%	0.209	44%	0.437	C	S	.	.			trans	-72.5	169.5	174.5	79.2	0.8	0	0	0	112.2	I55 K59 G60 R61 V63	I55-D57 PolarHBondContact O-N 3.38Å; D57-K59 PolarHBondContact O-N 3Å; D57-K59 VanDerWaalsContact OD1-C 3.22Å; D57-K59 VanDerWaalsContact OD1-CA 3.23Å; D57-K59 WeakPolarHBondContact OD1-CA 3.49Å; D57-K59 VanDerWaalsContact OD1-CB 3.31Å; D57-K59 WeakPolarHBondContact OD1-CB 3.39Å; D57-K59 PolarHBondContact OD1-N 3.15Å; D57-G60 PolarHBondContact O-N 3.14Å; D57-G60 PolarHBondContact OD1-N 3.3Å; D57-R61 PolarHBondContact N-O 2.98Å; D57-R61 WeakPolarHBondContact OD1-CB 3.47Å; D57-R61 PolarHBondContact OD1-N 2.84Å; D57-R61 IonicContact OD1-NE 2.81Å; D57-R61 IonicContact OD2-CZ 2.88Å; D57-R61 IonicContact OD2-NE 3.77Å; D57-R61 PolarHBondContact OD2-NE 3.34Å; D57-R61 IonicContact OD2-NH2 3.83Å; D57-R61 PolarHBondContact OD2-NH2 3.2Å; D57-V63 HydrophobicContact CB-CG2 4.08Å
58	A	93.2	Very high	91.7	Very high	115 Å²	115	85.9 Å²	85.9	95%	0.95	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-8.3	177.2	0	0	0	0	0	114.3
59	K	94.9	Very high	89.6	Confident	167 Å²	167	92.4 Å²	92.4	73%	0.726	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	6.5	174.7	-55	-177.3	179.1	-178.1	0	112	D57 R61	D57-K59 PolarHBondContact O-N 3Å; D57-K59 VanDerWaalsContact OD1-C 3.22Å; D57-K59 VanDerWaalsContact OD1-CA 3.23Å; D57-K59 WeakPolarHBondContact OD1-CA 3.49Å; D57-K59 VanDerWaalsContact OD1-CB 3.31Å; D57-K59 WeakPolarHBondContact OD1-CB 3.39Å; D57-K59 PolarHBondContact OD1-N 3.15Å; K59-R61 VanDerWaalsContact C-N 3.35Å; K59-R61 HydrophobicContact CB-CG 4.38Å
60	G	94.3	Very high	87.3	Confident	39 Å²	39	92.4 Å²	92.4	40%	0.402	50%	0.495	S	S	.	.	S	Bend	trans	80.8	7	179.5	0	0	0	0	0	115	Q56 D57	Q56-G60 VanDerWaalsContact CG-C 3.49Å; Q56-G60 PolarHBondContact NE2-O 3.49Å; D57-G60 PolarHBondContact O-N 3.14Å; D57-G60 PolarHBondContact OD1-N 3.3Å
61	R	94.9	Very high	84.7	Confident	147 Å²	147	94.2 Å²	94.2	56%	0.555	50%	0.498	S	S	*	.			trans	-95.4	139.1	-176.1	-52.2	176.5	-60.2	161.6	9.1	110.5	Q56 D57 K59 V63	Q56-R61 CarbonylContact C-O 3.59Å; Q56-R61 WeakPolarHBondContact CA-O 3.24Å; D57-R61 PolarHBondContact N-O 2.98Å; D57-R61 WeakPolarHBondContact OD1-CB 3.47Å; D57-R61 PolarHBondContact OD1-N 2.84Å; D57-R61 IonicContact OD1-NE 2.81Å; D57-R61 IonicContact OD2-CZ 2.88Å; D57-R61 IonicContact OD2-NE 3.77Å; D57-R61 PolarHBondContact OD2-NE 3.34Å; D57-R61 IonicContact OD2-NH2 3.83Å; D57-R61 PolarHBondContact OD2-NH2 3.2Å; K59-R61 VanDerWaalsContact C-N 3.35Å; K59-R61 HydrophobicContact CB-CG 4.38Å; R61-V63 PolarHBondContact O-N 2.64Å
62	F	95.3	Very high	82.2	Confident	73 Å²	73	97.3 Å²	97.3	32%	0.32	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	118.7	173	-73.9	-82.2	0	0	0	110.5	Y36 A46 I55 Q56	Y36-F62 HydrophobicContact CD1-CE1 4.33Å; Y36-F62 HydrophobicContact CD1-CE2 4.35Å; Y36-F62 AromaticContact CD1-CZ 3.83Å; Y36-F62 HydrophobicContact CD1-CZ 3.83Å; Y36-F62 HydrophobicContact CE1-CD2 4.46Å; Y36-F62 HydrophobicContact CE1-CE1 4.34Å; Y36-F62 AromaticContact CE1-CE2 3.81Å; Y36-F62 HydrophobicContact CE1-CE2 3.81Å; Y36-F62 AromaticContact CE1-CZ 3.74Å; Y36-F62 HydrophobicContact CE1-CZ 3.74Å; A46-F62 HydrophobicContact CB-CD1 3.92Å; A46-F62 HydrophobicContact CB-CE1 3.93Å; I55-F62 WeakPolarHBondContact O-CA 3.43Å; Q56-F62 HydrophobicContact CB-CD1 4.25Å; Q56-F62 HydrophobicContact CB-CE1 3.93Å; Q56-F62 HydrophobicContact CB-CZ 4.19Å; Q56-F62 HydrophobicContact CG-CZ 4.43Å
63	V	96.1	Very high	79.5	Confident	69 Å²	69	99.4 Å²	99.4	42%	0.418	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	140.2	176.6	-174.5	0	0	0	0	108.4	Y54 I55 D57 R61 W65	Y54-V63 CarbonylContact C-O 3.5Å; Y54-V63 WeakPolarHBondContact CA-O 3.35Å; I55-V63 PolarHBondContact N-O 3.33Å; I55-V63 PolarHBondContact O-N 2.7Å; D57-V63 HydrophobicContact CB-CG2 4.08Å; R61-V63 PolarHBondContact O-N 2.64Å; V63-W65 PolarHBondContact O-N 3.26Å
64	L	96.7	Very high	76.5	Confident	79 Å²	79	102.7 Å²	102.7	41%	0.414	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	123.3	178	-178.2	71.3	0	0	0	109.4	K52 Y54 T66	K52-L64 HydrophobicContact CB-CD1 3.87Å; K52-L64 HydrophobicContact CD-CD1 4.16Å; K52-L64 HydrophobicContact CG-CD1 4.41Å; Y54-L64 HydrophobicContact CD1-CB 4.29Å; Y54-L64 HydrophobicContact CD1-CD1 4.46Å; Y54-L64 HydrophobicContact CE1-CB 4.16Å; Y54-L64 HydrophobicContact CE1-CD1 4.01Å; Y54-L64 HydrophobicContact CE2-CD1 4.36Å; L64-T66 HydrophobicContact CD2-CG2 3.87Å; L64-T66 HydrophobicContact CG-CG2 4.1Å; L64-T66 PolarHBondContact O-N 3.42Å
65	W	93.1	Very high	73.5	Confident	107 Å²	107	107 Å²	107	41%	0.405	58%	0.58	S	S	.	*			trans	-80.2	88.1	176.7	-174.1	11.1	0	0	0	108.9	W21 F25 Y45 W53 V63	W21-W65 HydrophobicContact CZ3-CZ3 4.19Å; F25-W65 HydrophobicContact CZ-CZ3 4.49Å; Y45-W65 HydrophobicContact CD1-CE3 4.15Å; Y45-W65 HydrophobicContact CD1-CZ3 4.11Å; Y45-W65 HydrophobicContact CE1-CE3 4.23Å; Y45-W65 HydrophobicContact CE1-CH2 4.48Å; Y45-W65 HydrophobicContact CE1-CZ3 4.02Å; W53-W65 HydrophobicContact CB-CB 4.27Å; W53-W65 HydrophobicContact CB-CE3 3.93Å; W53-W65 WeakPolarHBondContact O-CB 3.3Å; W53-W65 PolarHBondContact O-N 3.5Å; V63-W65 PolarHBondContact O-N 3.26Å
66	T	86.7	Confident	70.4	Confident	64 Å²	64	109.6 Å²	109.6	39%	0.393	61%	0.608	S	S	.	*			trans	-82.5	138	167.8	53.2	0	0	0	0	109.2	L64 E68	L64-T66 HydrophobicContact CD2-CG2 3.87Å; L64-T66 HydrophobicContact CG-CG2 4.1Å; L64-T66 PolarHBondContact O-N 3.42Å; T66-E68 PolarHBondContact O-N 2.96Å; T66-E68 VanDerWaalsContact O-N 3.11Å
67	S	65.4	Low	67.7	Low	115 Å²	115	112.3 Å²	112.3	80%	0.804	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	9.3	-177.2	53.9	0	0	0	0	114.3
68	E	61.1	Low	65	Low	157 Å²	157	119.5 Å²	119.5	73%	0.734	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-22.4	-168	-65.2	-175.7	146.8	0	0	113.9	T66 E70	T66-E68 PolarHBondContact O-N 2.96Å; T66-E68 VanDerWaalsContact O-N 3.11Å; E68-E70 PolarHBondContact O-N 3.34Å
69	E	51.7	Low	62.6	Low	159 Å²	159	120.6 Å²	120.6	74%	0.743	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-82.7	-4.7	-173.1	-72.7	-163.7	140.8	0	0	115.7	T71	E69-T71 PolarHBondContact O-N 2.93Å
70	E	45.7	Very low	60.1	Low	176 Å²	176	121.5 Å²	121.5	82%	0.822	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-91.9	17.8	-173.1	-145.2	166.7	-151.2	0	0	114.9	E68	E68-E70 PolarHBondContact O-N 3.34Å
71	T	38.9	Very low	57.6	Low	115 Å²	115	128.9 Å²	128.9	71%	0.706	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-115.2	-3.1	-176.6	55.2	0	0	0	0	116.5	E69	E69-T71 PolarHBondContact O-N 2.93Å
72	T	40.2	Very low	54.9	Low	113 Å²	113	126.2 Å²	126.2	69%	0.693	69%	0.689	S	S	*	*	S	Bend	trans	-107.5	-4.8	-176.7	52.8	0	0	0	0	115.7	T74	T72-T74 PolarHBondContact O-N 2.93Å; T72-T74 VanDerWaalsContact O-N 3.11Å
73	N	38.6	Very low	52.4	Low	153 Å²	153	128.7 Å²	128.7	82%	0.818	72%	0.715	S	S	*	*			trans	-85	39.8	176.9	-78	-41.6	0	0	0	113.9
74	T	34.8	Very low	49.9	Very low	116 Å²	116	129.4 Å²	129.4	71%	0.712	73%	0.728	S	S	*	*			trans	-83.3	122.7	167.7	46.8	0	0	0	0	110.9	T72 A76	T72-T74 PolarHBondContact O-N 2.93Å; T72-T74 VanDerWaalsContact O-N 3.11Å; T74-A76 PolarHBondContact O-N 3.06Å
75	V	32.6	Very low	47.3	Very low	132 Å²	132	134.6 Å²	134.6	80%	0.8	75%	0.75	S	S	*	*			trans	-53.2	102.6	178	179.1	0	0	0	0	111.6	T77	V75-T77 HydrophobicContact CG1-CG2 4.21Å; V75-T77 PolarHBondContact O-N 3.45Å; V75-T77 VanDerWaalsContact O-N 3.13Å
76	A	32.9	Very low	44.9	Very low	101 Å²	101	136.7 Å²	136.7	84%	0.835	77%	0.769	S	S	*	*			trans	-79.6	89.6	172.2	0	0	0	0	0	110.3	T74 K78	T74-A76 PolarHBondContact O-N 3.06Å; A76-K78 PolarHBondContact O-N 3.29Å
77	T	39.1	Very low	42.7	Very low	123 Å²	123	139.1 Å²	139.1	76%	0.755	78%	0.783	S	S	*	*			trans	-68.1	121.8	167.2	47.3	0	0	0	0	110.4	V75	V75-T77 HydrophobicContact CG1-CG2 4.21Å; V75-T77 PolarHBondContact O-N 3.45Å; V75-T77 VanDerWaalsContact O-N 3.13Å
78	K	38	Very low	41.3	Very low	190 Å²	190	139 Å²	139	83%	0.826	78%	0.778	S	S	*	*			trans	-0.6	121.7	161.5	-69.8	178.8	170.6	-179.1	0	117.1	A76	A76-K78 PolarHBondContact O-N 3.29Å
79	N	42.9	Very low	40.4	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	78%	0.784	S	S	*	*				177.5	138.9	110.5	-87.1	-9.2	0	0	0	110.5
80	E	42.6	Very low	39.6	Very low	186 Å²	186	140.4 Å²	140.4	87%	0.869	79%	0.788	S	S	*	*			trans	55.9	145.2	159.2	-64.6	163.2	141.9	0	0	117
81	E	42.9	Very low	39.2	Very low	194 Å²	194	136.9 Å²	136.9	91%	0.907	79%	0.789	S	S	*	*			cis	-149.1	174.6	21.6	-159.1	173.3	-180	0	0	110.4
82	A	38.1	Very low	39	Very low	91 Å²	91	135.4 Å²	135.4	75%	0.752	79%	0.789	S	S	*	*			trans	-102.7	131.6	-167.7	0	0	0	0	0	115.4
83	S	42.7	Very low	38.7	Very low	125 Å²	125	136.9 Å²	136.9	87%	0.874	80%	0.797	S	S	*	*			trans	173.9	148.7	145.1	-84.6	0	0	0	0	108.6
84	A	44	Very low	38.5	Very low	83 Å²	83	134.3 Å²	134.3	69%	0.686	80%	0.797	S	S	*	*			cis	177.2	156.2	-15.7	0	0	0	0	0	104.3
85	E	41.8	Very low	38.6	Very low	188 Å²	188	138 Å²	138	88%	0.879	81%	0.806	S	S	*	*			trans	67	104.7	179.3	-54	-167	132.8	0	0	115
86	L	42.6	Very low	39	Very low	152 Å²	152	140.5 Å²	140.5	80%	0.796	81%	0.809	S	S	*	*			cis	64.7	111.3	45.5	-133.1	157.3	0	0	0	108.8
87	T	40.3	Very low	39.5	Very low	115 Å²	115	141.4 Å²	141.4	71%	0.706	81%	0.806	S	S	*	*				-171.7	123.3	75.6	-56.9	0	0	0	0	114.1
88	T	36.6	Very low	39.5	Very low	112 Å²	112	144.1 Å²	144.1	69%	0.687	81%	0.813	S	S	*	*			trans	48.9	120.7	140.2	-48.8	0	0	0	0	122.6
89	I	42.4	Very low	39.6	Very low	168 Å²	168	139.2 Å²	139.2	86%	0.862	81%	0.808	S	S	*	*				-151	137.9	106.6	-92.5	154	0	0	0	108.7
90	Q	34.9	Very low	39.7	Very low	177 Å²	177	140 Å²	140	83%	0.827	81%	0.812	S	S	*	*			trans	-106.2	174.3	-176.3	-81.4	-176.7	-24.4	0	0	112.6
91	A	35.7	Very low	39.2	Very low	102 Å²	102	139.7 Å²	139.7	84%	0.843	81%	0.81	S	S	*	*			trans	85.5	137.9	159.6	0	0	0	0	0	117.6
92	A	35.5	Very low	38.8	Very low	85 Å²	85	135.7 Å²	135.7	70%	0.702	80%	0.803	S	S	*	*			cis	-160	142.8	-14.3	0	0	0	0	0	112.5
93	V	34.1	Very low	38.7	Very low	144 Å²	144	136.8 Å²	136.8	87%	0.873	80%	0.8	S	S	*	*			trans	34.7	112.6	133	-171.1	0	0	0	0	119.1
94	A	35.2	Very low	38.6	Very low	98 Å²	98	139 Å²	139	81%	0.81	80%	0.796	S	S	*	*				178.9	119.3	110.1	0	0	0	0	0	110.9
95	E	35.5	Very low	38.3	Very low	193 Å²	193	143.1 Å²	143.1	90%	0.902	80%	0.803	S	S	*	*			trans	-92.8	136	168.2	-67.1	-177.8	123.6	0	0	110.4
96	E	40.9	Very low	38.2	Very low	186 Å²	186	142.5 Å²	142.5	87%	0.869	80%	0.801	S	S	*	*			trans	-134.7	120.7	149	-86.4	-158.2	152.3	0	0	109.1
97	P	44.5	Very low	38.4	Very low	119 Å²	119	141.8 Å²	141.8	77%	0.773	80%	0.796	S	S	*	*			trans	-83.8	113.2	165.3	31.6	-28	0	0	0	108.8	A99	P97-A99 PolarHBondContact O-N 3.39Å
98	M	39.5	Very low	38.8	Very low	180 Å²	180	141.1 Å²	141.1	89%	0.887	80%	0.795	S	S	*	*			trans	-63.8	99.3	168.5	-87.6	-170.1	62.3	0	0	109.8
99	A	39	Very low	39.2	Very low	87 Å²	87	142.9 Å²	142.9	72%	0.719	80%	0.8	S	S	*	*			trans	-61.3	134.8	170.5	0	0	0	0	0	109.8	P97 Q101	P97-A99 PolarHBondContact O-N 3.39Å; A99-Q101 PolarHBondContact O-N 3.04Å
100	N	44.6	Very low	39.6	Very low	154 Å²	154	141.1 Å²	141.1	82%	0.824	79%	0.792	S	S	*	*			trans	-60	113.7	174.2	-72.6	-44.2	0	0	0	109.3	C102	N100-C102 PolarHBondContact O-N 3.16Å
101	Q	32.4	Very low	40.3	Very low	180 Å²	180	140 Å²	140	84%	0.841	79%	0.792	S	S	*	*			trans	-73.5	81	176.6	-166.4	176.2	28.8	0	0	109.6	A99 V103	A99-Q101 PolarHBondContact O-N 3.04Å; Q101-V103 HydrophobicContact CG-CG2 4.25Å; Q101-V103 PolarHBondContact O-N 2.94Å
102	C	35.6	Very low	40.9	Very low	110 Å²	110	139.4 Å²	139.4	74%	0.743	79%	0.787	S	S	*	*			trans	-64.2	98.7	162.2	-70.1	0	0	0	0	107.9	N100 E104	N100-C102 PolarHBondContact O-N 3.16Å; C102-E104 VanDerWaalsContact C-N 3.32Å; C102-E104 PolarHBondContact O-N 3.08Å
103	V	36.1	Very low	42	Very low	114 Å²	114	143.3 Å²	143.3	69%	0.691	79%	0.791	S	S	*	*			trans	-72.7	94.8	165	179.3	0	0	0	0	106.9	Q101 M105	Q101-V103 HydrophobicContact CG-CG2 4.25Å; Q101-V103 PolarHBondContact O-N 2.94Å; V103-M105 PolarHBondContact O-N 3.01Å
104	E	39.5	Very low	43	Very low	172 Å²	172	141.2 Å²	141.2	80%	0.804	78%	0.779	S	S	*	*			trans	-61.9	116.9	162.1	-68.8	-177.1	142.7	0	0	107.6	C102 E106	C102-E104 VanDerWaalsContact C-N 3.32Å; C102-E104 PolarHBondContact O-N 3.08Å; E104-E106 PolarHBondContact O-N 3.46Å
105	M	37	Very low	43.6	Very low	169 Å²	169	146 Å²	146	83%	0.833	78%	0.784	S	S	*	*			trans	-78.8	97.4	163.5	-73.3	-171.8	-61.7	0	0	107.2	V103 I107	V103-M105 PolarHBondContact O-N 3.01Å; M105-I107 PolarHBondContact O-N 3.05Å
106	E	40	Very low	44.1	Very low	176 Å²	176	140.1 Å²	140.1	82%	0.822	78%	0.776	S	S	*	*			trans	-59	116.4	160.1	-76.1	-176.3	130.9	0	0	108.3	E104 C108	E104-E106 PolarHBondContact O-N 3.46Å; E106-C108 PolarHBondContact O-N 2.89Å
107	I	46.6	Very low	44.3	Very low	136 Å²	136	139.4 Å²	139.4	70%	0.697	78%	0.778	S	S	*	*			trans	-86.6	101.8	164.3	-61.3	175	0	0	0	105.1	M105 D109	M105-I107 PolarHBondContact O-N 3.05Å; I107-D109 PolarHBondContact O-N 2.78Å
108	C	49.1	Very low	44.5	Very low	101 Å²	101	137.2 Å²	137.2	68%	0.682	78%	0.777	S	S	*	*			trans	-71.5	94.4	169.6	-58.6	0	0	0	0	109	E106 D110	E106-C108 PolarHBondContact O-N 2.89Å; C108-D110 VanDerWaalsContact C-N 3.31Å; C108-D110 PolarHBondContact O-N 3.34Å
109	D	45.4	Very low	45.1	Very low	149 Å²	149	134.7 Å²	134.7	80%	0.797	77%	0.774	S	S	*	*			trans	-85.8	73.5	162.2	-75.1	-38	0	0	0	108.6	I107	I107-D109 PolarHBondContact O-N 2.78Å
110	D	51	Low	45.4	Very low	131 Å²	131	137.8 Å²	137.8	70%	0.701	78%	0.784	S	S	*	*			trans	-111.4	123.9	174.1	-77.9	-39.7	0	0	0	111.7	C108	C108-D110 VanDerWaalsContact C-N 3.31Å; C108-D110 PolarHBondContact O-N 3.34Å
111	D	49.1	Very low	45.2	Very low	153 Å²	153	135.7 Å²	135.7	82%	0.818	78%	0.781	S	S	*	*			trans	60.8	99	150.1	-58.1	-22.7	0	0	0	120.1
112	A	49.7	Very low	45.9	Very low	90 Å²	90	134.5 Å²	134.5	74%	0.744	78%	0.78	S	S	*	*			trans	-68.1	144.7	147.3	0	0	0	0	0	110.7
113	E	58.3	Low	46.2	Very low	167 Å²	167	136.7 Å²	136.7	78%	0.78	78%	0.779	S	S	*	*			trans	-159.3	152.5	143.9	-98.3	-42.7	156.3	0	0	112.3
114	T	53.7	Low	46.6	Very low	101 Å²	101	141.3 Å²	141.3	62%	0.62	78%	0.784	S	S	*	*			trans	50	107.1	155.9	54.4	0	0	0	0	119.8
115	E	49.3	Very low	46.8	Very low	198 Å²	198	138.6 Å²	138.6	93%	0.925	78%	0.78	S	S	*	*				97	143.1	81.6	-86	-170.1	174.5	0	0	113.1
116	G	45.4	Very low	47	Very low	70 Å²	70	138.4 Å²	138.4	72%	0.722	78%	0.782	S	S	*	*			trans	147.7	77.8	173.5	0	0	0	0	0	117.3
117	D	45.8	Very low	47.1	Very low	171 Å²	171	134 Å²	134	91%	0.914	78%	0.784	S	S	*	*			trans	46	118.9	146.3	-63	-32.4	0	0	0	123.6
118	G	48.2	Very low	46.9	Very low	73 Å²	73	132.4 Å²	132.4	75%	0.753	79%	0.791	S	S	*	*				110.2	118.5	102	0	0	0	0	0	118.4
119	P	51.7	Low	46.9	Very low	126 Å²	126	137.2 Å²	137.2	82%	0.818	80%	0.8	S	S	*	*			trans	-110.8	164.7	-172.3	40.5	-33.5	0	0	0	115
120	T	45.2	Very low	46.7	Very low	152 Å²	152	136.7 Å²	136.7	93%	0.933	80%	0.797	S	S	*	*			trans	-140.9	148.1	154.2	36.1	0	0	0	0	111.9
121	S	40	Very low	46.4	Very low	110 Å²	110	138.6 Å²	138.6	77%	0.769	80%	0.802	S	S	*	*			trans	-105.7	154.5	-176.6	53.6	0	0	0	0	111.9
122	L	46.7	Very low	46.1	Very low	156 Å²	156	136.9 Å²	136.9	82%	0.817	80%	0.796	S	S	*	*			trans	-152.4	140	151.6	-140.7	79.5	0	0	0	112.6
123	E	43	Very low	45.6	Very low	156 Å²	156	138.9 Å²	138.9	73%	0.729	80%	0.8	S	S	*	*			trans	6.6	159.9	151	-67.1	-173.8	120.3	0	0	122
124	R	43.8	Very low	44.7	Very low	211 Å²	211	133.9 Å²	133.9	80%	0.796	79%	0.793	S	S	*	*			cis	160.1	151.8	-22.2	-115.1	-175.9	176.4	-178.3	0.4	105.7
125	T	44.5	Very low	44.1	Very low	115 Å²	115	137.7 Å²	137.7	71%	0.706	80%	0.803	S	S	*	*			trans	69.5	104.9	156.5	50.5	0	0	0	0	122.1
126	N	40.3	Very low	43.5	Very low	165 Å²	165	133 Å²	133	88%	0.882	79%	0.793	S	S	*	*				47	121.5	117.8	-55.1	-8.4	0	0	0	121.5
127	G	43.1	Very low	43.3	Very low	84 Å²	84	135.1 Å²	135.1	87%	0.866	80%	0.796	S	S	*	*			trans	-165.2	127.9	155.8	0	0	0	0	0	111.4
128	A	41.6	Very low	43.1	Very low	101 Å²	101	131.4 Å²	131.4	84%	0.835	79%	0.789	S	S	*	*			trans	-127.8	137.7	-177.9	0	0	0	0	0	111.4
129	K	49.6	Very low	42.6	Very low	203 Å²	203	136.4 Å²	136.4	88%	0.883	79%	0.793	S	S	*	*			trans	-170.9	146.5	148.6	-124.9	170.9	179.5	174.4	0	114.8
130	D	40	Very low	42.1	Very low	138 Å²	138	135 Å²	135	74%	0.738	79%	0.791	S	S	*	*			trans	-79.3	159.7	171.7	-43.4	-89	0	0	0	112.9
131	H	45.9	Very low	41.9	Very low	171 Å²	171	131.5 Å²	131.5	79%	0.792	78%	0.779	S	S	*	*				165.2	146.9	118.5	-100.4	-83.2	0	0	0	115.7
132	V	42.5	Very low	41.9	Very low	116 Å²	116	134 Å²	134	70%	0.703	78%	0.783	S	S	*	*			trans	72.9	122.9	145.7	169	0	0	0	0	118.3
133	T	38.1	Very low	41.5	Very low	133 Å²	133	130.8 Å²	130.8	82%	0.816	78%	0.779	S	S	*	*			cis	101.6	123.2	35.9	-50.6	0	0	0	0	113.9
134	G	39.1	Very low	41.1	Very low	62 Å²	62	128.9 Å²	128.9	64%	0.639	78%	0.783	S	S	*	*			trans	172.7	121.8	164.7	0	0	0	0	0	111.4
135	H	41.6	Very low	40.9	Very low	180 Å²	180	126.5 Å²	126.5	83%	0.833	78%	0.784	S	S	*	*				85	145.1	71.7	-81.9	-60.5	0	0	0	115.4
136	S	37.8	Very low	40.7	Very low	101 Å²	101	125.7 Å²	125.7	71%	0.706	79%	0.79	S	S	*	*				-179	124.9	-62.9	49.5	0	0	0	0	112.4
137	S	39.7	Very low	40.4	Very low	114 Å²	114	121 Å²	121	80%	0.797	78%	0.78	S	S	*	*			trans	-161.2	122.8	172.5	-161.7	0	0	0	0	109.9
138	A	41.6	Very low	40.2	Very low	92 Å²	92	122.4 Å²	122.4	76%	0.76	78%	0.777	S	S	*	*				62.1	132.1	75.1	0	0	0	0	0	112.7
139	E	38.9	Very low	40	Very low	179 Å²	179	123.7 Å²	123.7	84%	0.836	78%	0.779	S	S	*	*			cis	-169.4	134	49.2	-177.4	167.5	-172.7	0	0	110.5
140	A	40.3	Very low	39.2	Very low	95 Å²	95	117.3 Å²	117.3	79%	0.785	77%	0.771	S	S	*	*				52.3	148.8	106	0	0	0	0	0	117.9
141	A	41.1	Very low	39.1	Very low	80 Å²	80	119.1 Å²	119.1	66%	0.661	78%	0.78	S	S	*	*			cis	-164.2	163.1	10.5	0	0	0	0	0	114.5
142	N	40.9	Very low	38.9	Very low	163 Å²	163	117 Å²	117	87%	0.872	78%	0.779	S	S	*	*			trans	50.8	154.2	140.4	-60.7	-13.3	0	0	0	122.6
143	A	38.1	Very low	38.9	Very low	88 Å²	88	116.7 Å²	116.7	73%	0.727	78%	0.779	S	S	*	*			cis	-159.9	140.5	-6.8	0	0	0	0	0	108.4
144	S	34.8	Very low	38.8	Very low	116 Å²	116	116.2 Å²	116.2	81%	0.811	77%	0.772	S	S	*	*				64.2	122.9	85.2	-158.9	0	0	0	0	118.6
145	I	40	Very low	38.7	Very low	160 Å²	160	120.6 Å²	120.6	82%	0.821	78%	0.775	S	S	*	*			trans	156.6	108.4	156.3	-85.6	155.2	0	0	0	107.1
146	A	38.7	Very low	38.3	Very low	99 Å²	99	117.2 Å²	117.2	82%	0.818	77%	0.772	S	S	*	*				59.8	132.2	79.6	0	0	0	0	0	114.5
147	G	35	Very low	38.4	Very low	65 Å²	65	117.6 Å²	117.6	67%	0.67	78%	0.775	S	S	*	*			cis	177.2	-160.8	2	0	0	0	0	0	111.4
148	S	40	Very low	38.3	Very low	115 Å²	115	119 Å²	119	80%	0.804	77%	0.773	S	S	*	*			trans	72.5	124.4	-176.6	71.9	0	0	0	0	115.5
149	S	37.4	Very low	38	Very low	127 Å²	127	121.7 Å²	121.7	89%	0.888	77%	0.774	S	S	*	*				63.8	121	56.8	-59.4	0	0	0	0	112
150	G	31.9	Very low	37.7	Very low	69 Å²	69	120.5 Å²	120.5	71%	0.711	77%	0.774	S	S	*	*			cis	139.7	146.7	6.5	0	0	0	0	0	109
151	L	38.9	Very low	37.5	Very low	177 Å²	177	120.6 Å²	120.6	93%	0.927	77%	0.774	S	S	*	*			trans	172.1	151.8	158.2	-96.1	166	0	0	0	110.8
152	V	40	Very low	37.2	Very low	127 Å²	127	123.9 Å²	123.9	77%	0.77	79%	0.786	S	S	*	*			trans	-157	158.2	-169.8	-178	0	0	0	0	106.5
153	P	42.4	Very low	37.1	Very low	109 Å²	109	121.5 Å²	121.5	71%	0.708	77%	0.774	S	S	*	*			cis	-116.9	-159.9	-40.6	38.5	-21.1	0	0	0	110.4
154	D	36.6	Very low	37.2	Very low	123 Å²	123	122.6 Å²	122.6	66%	0.658	77%	0.773	S	S	*	*				162.4	162.6	101.5	-151.6	6.4	0	0	0	115
155	Q	37.2	Very low	37.6	Very low	153 Å²	153	122.9 Å²	122.9	72%	0.715	77%	0.765	S	S	*	*			trans	66.2	91.4	154.3	-79.9	165.9	63.6	0	0	123
156	S	32.6	Very low	37.7	Very low	110 Å²	110	121.1 Å²	121.1	77%	0.769	76%	0.762	S	S	*	*				37	123.2	117.9	63.3	0	0	0	0	123.2
157	S	40.4	Very low	37.7	Very low	109 Å²	109	124.2 Å²	124.2	76%	0.762	76%	0.759	S	S	*	*			trans	-162.4	120.5	134.9	63.7	0	0	0	0	115.4
158	N	38.1	Very low	38	Very low	142 Å²	142	130.5 Å²	130.5	76%	0.759	76%	0.763	S	S	*	*			trans	49.1	111.5	140.5	-64.5	-32.5	0	0	0	123.7
159	L	34.9	Very low	38	Very low	150 Å²	150	134.3 Å²	134.3	79%	0.785	76%	0.76	S	S	*	*				58.1	142.4	115.4	-66.8	166.1	0	0	0	122.7
160	N	33.6	Very low	38.3	Very low	154 Å²	154	131.7 Å²	131.7	82%	0.824	75%	0.746	S	S	*	*			trans	75.2	88.1	161.4	-66.3	-9.3	0	0	0	119.6
161	A	35.2	Very low	38.9	Very low	96 Å²	96	132.5 Å²	132.5	79%	0.793	74%	0.736	S	S	*	*				-160.8	115.6	129.9	0	0	0	0	0	111.3
162	T	34.6	Very low	39.4	Very low	149 Å²	149	127.2 Å²	127.2	91%	0.914	72%	0.715	S	S	*	*			trans	-67	126.5	166.8	43	0	0	0	0	110.2
163	N	39.7	Very low	40.2	Very low	114 Å²	114	126.7 Å²	126.7	61%	0.61	71%	0.707	S	S	*	*			trans	-134.9	124	-176	-155.6	-4.1	0	0	0	110.4	L165	N163-L165 PolarHBondContact O-N 2.98Å
164	P	40.4	Very low	41	Very low	111 Å²	111	129.4 Å²	129.4	72%	0.721	70%	0.704	S	S	*	*			trans	-79.2	47.4	-173.2	33.9	-38.3	0	0	0	113.6
165	L	41.2	Very low	42.3	Very low	122 Å²	122	128.5 Å²	128.5	64%	0.639	70%	0.695	S	S	*	*			trans	-91.3	-6.5	-179.2	-108.3	91.8	0	0	0	114.6	N163	N163-L165 PolarHBondContact O-N 2.98Å
166	T	42.9	Very low	43.5	Very low	122 Å²	122	125.1 Å²	125.1	75%	0.748	68%	0.682	S	S	*	*	S	Bend	trans	-79.7	-20.5	-172.1	-23.6	0	0	0	0	113.9
167	E	39.7	Very low	44.9	Very low	164 Å²	164	125.8 Å²	125.8	77%	0.766	67%	0.669	S	S	*	*	S	Bend	trans	-78.7	-25.8	-175.7	-162	163.3	-159.6	0	0	112.7
168	W	40.9	Very low	45.7	Very low	198 Å²	198	121.8 Å²	121.8	75%	0.75	64%	0.641	S	S	*	*	S	Bend	trans	-76.9	-23.1	-179.2	-75.6	86	0	0	0	114.5	A170 V171	W168-A170 VanDerWaalsContact C-N 3.35Å; W168-A170 PolarHBondContact O-N 3.25Å; W168-V171 PolarHBondContact O-N 3.02Å
169	R	39.9	Very low	46.9	Very low	195 Å²	195	119 Å²	119	74%	0.736	62%	0.622	S	S	*	*	H	α-helix	trans	-66.1	-34.8	179.4	-79.4	-167.1	177.6	-153.4	-1.1	113.3	V171 S172 D173	R169-V171 PolarHBondContact O-N 2.77Å; R169-S172 PolarHBondContact O-N 2.93Å; R169-D173 PolarHBondContact O-N 3.27Å
170	A	43.5	Very low	48.1	Very low	72 Å²	72	117.4 Å²	117.4	60%	0.595	61%	0.61	S	S	*	*	H	α-helix	trans	-66	-20.5	-176.8	0	0	0	0	0	113.8	W168	W168-A170 VanDerWaalsContact C-N 3.35Å; W168-A170 PolarHBondContact O-N 3.25Å
171	V	43.8	Very low	49.1	Very low	85 Å²	85	113.4 Å²	113.4	52%	0.515	58%	0.584	S	S	.	*	H	α-helix	trans	-82.5	-41.9	177.8	-175.2	0	0	0	0	110.9	W168 R169 D173 W174 E175	W168-V171 PolarHBondContact O-N 3.02Å; R169-V171 PolarHBondContact O-N 2.77Å; V171-D173 PolarHBondContact O-N 3.28Å; V171-W174 PolarHBondContact O-N 3.4Å; V171-E175 PolarHBondContact O-N 3.26Å
172	S	50.6	Low	49.9	Very low	67 Å²	67	114.2 Å²	114.2	47%	0.469	57%	0.568	S	S	.	*	H	α-helix	trans	-62.8	-41.5	178.1	-54.2	0	0	0	0	112.7	R169 W174 E175 D176	R169-S172 PolarHBondContact O-N 2.93Å; S172-W174 PolarHBondContact O-N 3.43Å; S172-E175 PolarHBondContact O-N 2.83Å; S172-D176 PolarHBondContact O-N 3.41Å; S172-D176 VanDerWaalsContact O-N 3.16Å
173	D	57.1	Low	50.9	Low	116 Å²	116	113.5 Å²	113.5	62%	0.62	55%	0.554	S	S	*	*	H	α-helix	trans	-58.8	-31.8	178.5	-68.1	-21.9	0	0	0	112.3	R169 V171 Y177	R169-D173 PolarHBondContact O-N 3.27Å; V171-D173 PolarHBondContact O-N 3.28Å; D173-Y177 WeakPolarHBondContact O-CB 3.49Å; D173-Y177 PolarHBondContact O-N 2.85Å
174	W	59.1	Low	51.6	Low	166 Å²	166	112.3 Å²	112.3	63%	0.629	55%	0.545	S	S	*	.	H	α-helix	trans	-77.3	-37.8	177.8	178.6	-106.8	0	0	0	113.3	V171 S172 D176 Y177 S178	V171-W174 PolarHBondContact O-N 3.4Å; S172-W174 PolarHBondContact O-N 3.43Å; W174-D176 VanDerWaalsContact C-N 3.34Å; W174-Y177 AromaticContact CE3-CD1 3.82Å; W174-Y177 HydrophobicContact CE3-CD1 3.82Å; W174-Y177 HydrophobicContact CH2-CD1 4.3Å; W174-Y177 HydrophobicContact CH2-CE1 4.36Å; W174-Y177 AromaticContact CZ3-CD1 3.55Å; W174-Y177 HydrophobicContact CZ3-CD1 3.55Å; W174-Y177 AromaticContact CZ3-CE1 3.79Å; W174-Y177 HydrophobicContact CZ3-CE1 3.79Å; W174-S178 VanDerWaalsContact O-CB 3.26Å; W174-S178 WeakPolarHBondContact O-CB 3.41Å; W174-S178 PolarHBondContact O-N 3.4Å; W174-S178 PolarHBondContact O-OG 2.87Å
175	E	62.4	Low	52	Low	103 Å²	103	112.6 Å²	112.6	48%	0.481	53%	0.532	S	S	.	.	H	α-helix	trans	-62.1	-43.8	174.7	-71	-170.1	180	0	0	111.2	V171 S172 S178 K179	V171-E175 PolarHBondContact O-N 3.26Å; S172-E175 PolarHBondContact O-N 2.83Å; E175-S178 PolarHBondContact O-N 3.04Å; E175-S178 PolarHBondContact O-OG 3.15Å; E175-K179 WeakPolarHBondContact O-CB 3.34Å; E175-K179 WeakPolarHBondContact O-CD 3.49Å; E175-K179 WeakPolarHBondContact O-CG 3.36Å; E175-K179 PolarHBondContact O-N 3.35Å; E175-K179 IonicContact OE2-NZ 3.34Å
176	D	63.8	Low	51.8	Low	82 Å²	82	109.5 Å²	109.5	44%	0.439	53%	0.529	S	S	.	.	H	α-helix	trans	-74.7	-36.6	-179.8	-69.7	-16.7	0	0	0	112.4	S172 W174 K179 Q180	S172-D176 PolarHBondContact O-N 3.41Å; S172-D176 VanDerWaalsContact O-N 3.16Å; W174-D176 VanDerWaalsContact C-N 3.34Å; D176-K179 IonicContact OD1-NZ 2.7Å; D176-K179 PolarHBondContact OD1-NZ 3.03Å; D176-Q180 WeakPolarHBondContact O-CB 3.47Å; D176-Q180 VanDerWaalsContact O-CG 3.32Å; D176-Q180 WeakPolarHBondContact O-CG 3.35Å; D176-Q180 PolarHBondContact O-N 3.49Å
177	Y	62.1	Low	51.7	Low	125 Å²	125	107.8 Å²	107.8	49%	0.49	51%	0.51	S	S	.	.	H	α-helix	trans	-60.3	-45.1	170	177.5	-97.9	0	0	0	112	D173 W174 Q180 Y181	D173-Y177 WeakPolarHBondContact O-CB 3.49Å; D173-Y177 PolarHBondContact O-N 2.85Å; W174-Y177 AromaticContact CE3-CD1 3.82Å; W174-Y177 HydrophobicContact CE3-CD1 3.82Å; W174-Y177 HydrophobicContact CH2-CD1 4.3Å; W174-Y177 HydrophobicContact CH2-CE1 4.36Å; W174-Y177 AromaticContact CZ3-CD1 3.55Å; W174-Y177 HydrophobicContact CZ3-CD1 3.55Å; W174-Y177 AromaticContact CZ3-CE1 3.79Å; W174-Y177 HydrophobicContact CZ3-CE1 3.79Å; Y177-Q180 PolarHBondContact O-N 3.37Å; Y177-Y181 HydrophobicContact CE1-CD2 4.42Å; Y177-Y181 WeakPolarHBondContact O-CB 3.43Å; Y177-Y181 PolarHBondContact O-N 3.49Å
178	S	56.6	Low	51.6	Low	24 Å²	24	104 Å²	104	17%	0.168	49%	0.493	C	S	.	.	H	α-helix	trans	-69.3	-40	-179.7	61.9	0	0	0	0	112.3	W174 E175 Q180 Y181 Y182	W174-S178 VanDerWaalsContact O-CB 3.26Å; W174-S178 WeakPolarHBondContact O-CB 3.41Å; W174-S178 PolarHBondContact O-N 3.4Å; W174-S178 PolarHBondContact O-OG 2.87Å; E175-S178 PolarHBondContact O-N 3.04Å; E175-S178 PolarHBondContact O-OG 3.15Å; S178-Q180 PolarHBondContact O-N 3.2Å; S178-Y181 PolarHBondContact O-N 3.45Å; S178-Y182 WeakPolarHBondContact O-CB 3.26Å; S178-Y182 WeakPolarHBondContact O-CD2 3.46Å; S178-Y182 PolarHBondContact O-N 2.97Å
179	K	62.3	Low	51.5	Low	83 Å²	83	98.1 Å²	98.1	36%	0.361	48%	0.48	S	S	.	.	H	α-helix	trans	-55.2	-49.9	169.6	-71.8	164	-155	157.8	0	111.2	E175 D176 Y181 Y182 Q183 M188	E175-K179 WeakPolarHBondContact O-CB 3.34Å; E175-K179 WeakPolarHBondContact O-CD 3.49Å; E175-K179 WeakPolarHBondContact O-CG 3.36Å; E175-K179 PolarHBondContact O-N 3.35Å; E175-K179 IonicContact OE2-NZ 3.34Å; D176-K179 IonicContact OD1-NZ 2.7Å; D176-K179 PolarHBondContact OD1-NZ 3.03Å; K179-Y181 VanDerWaalsContact C-N 3.35Å; K179-Y181 PolarHBondContact O-N 3.23Å; K179-Y182 PolarHBondContact O-N 3.13Å; K179-Q183 WeakPolarHBondContact O-CB 3.33Å; K179-Q183 VanDerWaalsContact O-CG 3.31Å; K179-Q183 WeakPolarHBondContact O-CG 3.44Å; K179-Q183 PolarHBondContact O-N 2.92Å; K179-M188 HydrophobicContact CG-SD 4.47Å
180	Q	61.3	Low	51.4	Low	118 Å²	118	94.9 Å²	94.9	55%	0.551	48%	0.482	S	S	*	.	H	α-helix	trans	-63.5	-38	177.9	-71.7	-179.4	20.3	0	0	112.9	D176 Y177 S178 Q184	D176-Q180 WeakPolarHBondContact O-CB 3.47Å; D176-Q180 VanDerWaalsContact O-CG 3.32Å; D176-Q180 WeakPolarHBondContact O-CG 3.35Å; D176-Q180 PolarHBondContact O-N 3.49Å; Y177-Q180 PolarHBondContact O-N 3.37Å; S178-Q180 PolarHBondContact O-N 3.2Å; Q180-Q184 WeakPolarHBondContact O-CB 3.49Å; Q180-Q184 PolarHBondContact O-N 2.99Å
181	Y	53.1	Low	51.1	Low	69 Å²	69	99.4 Å²	99.4	27%	0.271	49%	0.485	S	S	.	.	H	α-helix	trans	-65.5	-51.4	176.5	-169.3	-87.5	0	0	0	111	Y177 S178 K179 Q183 Q184 Y185	Y177-Y181 HydrophobicContact CE1-CD2 4.42Å; Y177-Y181 WeakPolarHBondContact O-CB 3.43Å; Y177-Y181 PolarHBondContact O-N 3.49Å; S178-Y181 PolarHBondContact O-N 3.45Å; K179-Y181 VanDerWaalsContact C-N 3.35Å; K179-Y181 PolarHBondContact O-N 3.23Å; Y181-Q183 PolarHBondContact O-N 2.74Å; Y181-Q184 WeakPolarHBondContact O-CB 3.3Å; Y181-Q184 PolarHBondContact O-N 2.83Å; Y181-Y185 AromaticContact CD1-CD2 3.98Å; Y181-Y185 HydrophobicContact CD1-CD2 3.98Å; Y181-Y185 HydrophobicContact CD1-CE2 4.18Å; Y181-Y185 HydrophobicContact CD2-CE2 4.11Å; Y181-Y185 AromaticContact CE1-CD2 3.78Å; Y181-Y185 HydrophobicContact CE1-CD2 3.78Å; Y181-Y185 AromaticContact CE1-CE2 3.75Å; Y181-Y185 HydrophobicContact CE1-CE2 3.75Å; Y181-Y185 HydrophobicContact CE2-CD2 4.45Å; Y181-Y185 AromaticContact CE2-CE2 3.7Å; Y181-Y185 HydrophobicContact CE2-CE2 3.7Å; Y181-Y185 HydrophobicContact CG-CD2 4.38Å; Y181-Y185 HydrophobicContact CG-CE2 4.33Å; Y181-Y185 AromaticContact CZ-CE2 3.5Å; Y181-Y185 VanDerWaalsContact O-CD2 3.28Å; Y181-Y185 WeakPolarHBondContact O-CD2 3.41Å; Y181-Y185 PolarHBondContact O-N 3.41Å
182	Y	52.5	Low	50.7	Low	114 Å²	114	102.7 Å²	102.7	45%	0.447	50%	0.495	S	S	.	.	H	α-helix	trans	-66.9	-35.1	179.3	-69.3	-56.9	0	0	0	113	S178 K179 Y185 G186 Y187	S178-Y182 WeakPolarHBondContact O-CB 3.26Å; S178-Y182 WeakPolarHBondContact O-CD2 3.46Å; S178-Y182 PolarHBondContact O-N 2.97Å; K179-Y182 PolarHBondContact O-N 3.13Å; Y182-Y185 PolarHBondContact O-N 3.14Å; Y182-G186 PolarHBondContact O-N 3.22Å; Y182-Y187 HydrophobicContact CD1-CD2 4.3Å; Y182-Y187 HydrophobicContact CD1-CG 4.5Å; Y182-Y187 PolarHBondContact O-N 3.28Å
183	Q	56.3	Low	49.9	Very low	133 Å²	133	104 Å²	104	62%	0.621	51%	0.51	S	S	*	.	H	α-helix	trans	-61.6	-44.5	170.3	-78.6	-178.7	-0.8	0	0	112	K179 Y181 Y185 G186	K179-Q183 WeakPolarHBondContact O-CB 3.33Å; K179-Q183 VanDerWaalsContact O-CG 3.31Å; K179-Q183 WeakPolarHBondContact O-CG 3.44Å; K179-Q183 PolarHBondContact O-N 2.92Å; Y181-Q183 PolarHBondContact O-N 2.74Å; Q183-Y185 VanDerWaalsContact C-N 3.26Å; Q183-Y185 PolarHBondContact O-N 3.35Å; Q183-G186 PolarHBondContact O-N 2.94Å; Q183-G186 VanDerWaalsContact O-N 3.15Å
184	Q	54	Low	48.9	Very low	90 Å²	90	101.7 Å²	101.7	42%	0.421	50%	0.5	S	S	.	.	H	α-helix	trans	-59.3	-36.3	-179.9	-172.9	-151.7	-16.6	0	0	112.9	Q180 Y181 R496	Q180-Q184 WeakPolarHBondContact O-CB 3.49Å; Q180-Q184 PolarHBondContact O-N 2.99Å; Y181-Q184 WeakPolarHBondContact O-CB 3.3Å; Y181-Q184 PolarHBondContact O-N 2.83Å; Q184-R496 VanDerWaalsContact CD-CZ 3.45Å; Q184-R496 VanDerWaalsContact CD-NH2 3.34Å; Q184-R496 VanDerWaalsContact OE1-CZ 3.22Å
185	Y	47.9	Very low	47.9	Very low	117 Å²	117	99.5 Å²	99.5	46%	0.459	52%	0.517	S	S	.	.	H	α-helix	trans	-95.8	1.9	179.9	-67.8	-76.4	0	0	0	114	Y181 Y182 Q183 Y187	Y181-Y185 AromaticContact CD1-CD2 3.98Å; Y181-Y185 HydrophobicContact CD1-CD2 3.98Å; Y181-Y185 HydrophobicContact CD1-CE2 4.18Å; Y181-Y185 HydrophobicContact CD2-CE2 4.11Å; Y181-Y185 AromaticContact CE1-CD2 3.78Å; Y181-Y185 HydrophobicContact CE1-CD2 3.78Å; Y181-Y185 AromaticContact CE1-CE2 3.75Å; Y181-Y185 HydrophobicContact CE1-CE2 3.75Å; Y181-Y185 HydrophobicContact CE2-CD2 4.45Å; Y181-Y185 AromaticContact CE2-CE2 3.7Å; Y181-Y185 HydrophobicContact CE2-CE2 3.7Å; Y181-Y185 HydrophobicContact CG-CD2 4.38Å; Y181-Y185 HydrophobicContact CG-CE2 4.33Å; Y181-Y185 AromaticContact CZ-CE2 3.5Å; Y181-Y185 VanDerWaalsContact O-CD2 3.28Å; Y181-Y185 WeakPolarHBondContact O-CD2 3.41Å; Y181-Y185 PolarHBondContact O-N 3.41Å; Y182-Y185 PolarHBondContact O-N 3.14Å; Q183-Y185 VanDerWaalsContact C-N 3.26Å; Q183-Y185 PolarHBondContact O-N 3.35Å; Y185-Y187 VanDerWaalsContact CB-CE2 3.42Å; Y185-Y187 HydrophobicContact CG-CD2 4.43Å; Y185-Y187 HydrophobicContact CG-CE2 4.21Å
186	G	38.6	Very low	47	Very low	56 Å²	56	100.3 Å²	100.3	58%	0.577	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	27.8	177.9	0	0	0	0	0	114.4	Y182 Q183	Y182-G186 PolarHBondContact O-N 3.22Å; Q183-G186 PolarHBondContact O-N 2.94Å; Q183-G186 VanDerWaalsContact O-N 3.15Å
187	Y	41.2	Very low	45.8	Very low	87 Å²	87	99.7 Å²	99.7	34%	0.341	54%	0.538	S	S	.	.			trans	-97.8	-7.9	-177	-69.7	-55.1	0	0	0	114.5	Y182 Y185	Y182-Y187 HydrophobicContact CD1-CD2 4.3Å; Y182-Y187 HydrophobicContact CD1-CG 4.5Å; Y182-Y187 PolarHBondContact O-N 3.28Å; Y185-Y187 VanDerWaalsContact CB-CE2 3.42Å; Y185-Y187 HydrophobicContact CG-CD2 4.43Å; Y185-Y187 HydrophobicContact CG-CE2 4.21Å
188	M	36.1	Very low	44.5	Very low	85 Å²	85	96.7 Å²	96.7	42%	0.419	54%	0.535	S	S	.	.	S	Bend	trans	-90.5	131.5	174.7	-103	-147.3	72.2	0	0	111.9	K179 T190	K179-M188 HydrophobicContact CG-SD 4.47Å; M188-T190 PolarHBondContact O-N 3.34Å
189	P	39.1	Very low	43.9	Very low	74 Å²	74	102.5 Å²	102.5	48%	0.481	56%	0.563	S	S	.	*			trans	-70.2	120.2	164	28.6	-30.7	0	0	0	109.5	Y191	P189-Y191 HydrophobicContact CB-CD2 4.31Å; P189-Y191 HydrophobicContact CB-CE2 3.87Å; P189-Y191 HydrophobicContact CG-CD2 4.29Å; P189-Y191 HydrophobicContact CG-CE2 3.67Å; P189-Y191 PolarHBondContact O-N 2.86Å
190	T	38.7	Very low	42.5	Very low	126 Å²	126	100.3 Å²	100.3	77%	0.773	56%	0.564	S	S	*	*			trans	-77.4	96	168.6	47.2	0	0	0	0	109	M188 E192	M188-T190 PolarHBondContact O-N 3.34Å; T190-E192 PolarHBondContact O-N 3.46Å
191	Y	36.9	Very low	41.1	Very low	168 Å²	168	98.6 Å²	98.6	66%	0.659	58%	0.578	S	S	*	*			trans	-78.4	112.1	163.4	-66.1	-80	0	0	0	108.3	P189 A193 I199	P189-Y191 HydrophobicContact CB-CD2 4.31Å; P189-Y191 HydrophobicContact CB-CE2 3.87Å; P189-Y191 HydrophobicContact CG-CD2 4.29Å; P189-Y191 HydrophobicContact CG-CE2 3.67Å; P189-Y191 PolarHBondContact O-N 2.86Å; Y191-A193 PolarHBondContact O-N 2.91Å; Y191-I199 HydrophobicContact CD1-CG2 4.23Å
192	E	35.7	Very low	40.2	Very low	154 Å²	154	98.2 Å²	98.2	72%	0.72	60%	0.595	S	S	*	*			trans	-72.7	107.9	166.4	-69.6	-174.7	177.2	0	0	108	T190 T194	T190-E192 PolarHBondContact O-N 3.46Å; E192-T194 PolarHBondContact O-N 3.26Å
193	A	33.7	Very low	39.5	Very low	95 Å²	95	97.5 Å²	97.5	79%	0.785	61%	0.605	S	S	*	*	B	Isolated β-bridge	trans	-81.1	106.5	169.9	0	0	0	0	0	108.4	Y191	Y191-A193 PolarHBondContact O-N 2.91Å
194	T	35	Very low	38.7	Very low	67 Å²	67	96.4 Å²	96.4	41%	0.411	61%	0.609	S	S	.	*			trans	-68.3	151.9	168.6	39.3	0	0	0	0	110.3	E192 D196 G197 S198	E192-T194 PolarHBondContact O-N 3.26Å; T194-D196 VanDerWaalsContact CB-OD1 3.29Å; T194-D196 WeakPolarHBondContact CB-OD1 3.14Å; T194-D196 PolarHBondContact O-N 3.14Å; T194-D196 PolarHBondContact OG1-OD1 2.88Å; T194-G197 PolarHBondContact O-N 3.12Å; T194-S198 PolarHBondContact OG1-O 3.2Å; T194-S198 PolarHBondContact OG1-OG 3.26Å
195	A	38.7	Very low	37.9	Very low	120 Å²	120	100.6 Å²	100.6	99%	0.992	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-3.2	-174.9	0	0	0	0	0	114.8
196	D	43	Very low	37.3	Very low	120 Å²	120	99.9 Å²	99.9	64%	0.642	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-0.1	175.3	56.1	20.5	0	0	0	113.7	T194 S198	T194-D196 VanDerWaalsContact CB-OD1 3.29Å; T194-D196 WeakPolarHBondContact CB-OD1 3.14Å; T194-D196 PolarHBondContact O-N 3.14Å; T194-D196 PolarHBondContact OG1-OD1 2.88Å; D196-S198 PolarHBondContact O-N 3.13Å; D196-S198 WeakPolarHBondContact OD1-CB 3.36Å; D196-S198 PolarHBondContact OD1-N 3.43Å; D196-S198 PolarHBondContact OD1-OG 3.29Å
197	G	38.4	Very low	37.3	Very low	69 Å²	69	101.8 Å²	101.8	71%	0.711	64%	0.635	S	S	*	*			trans	72	8.5	-180	0	0	0	0	0	114.2	T194	T194-G197 PolarHBondContact O-N 3.12Å
198	S	36.3	Very low	37.2	Very low	62 Å²	62	99.1 Å²	99.1	43%	0.434	63%	0.631	S	S	.	*			trans	-78.7	129.3	171.8	71.5	0	0	0	0	110.3	T194 D196 G200	T194-S198 PolarHBondContact OG1-O 3.2Å; T194-S198 PolarHBondContact OG1-OG 3.26Å; D196-S198 PolarHBondContact O-N 3.13Å; D196-S198 WeakPolarHBondContact OD1-CB 3.36Å; D196-S198 PolarHBondContact OD1-N 3.43Å; D196-S198 PolarHBondContact OD1-OG 3.29Å; S198-G200 PolarHBondContact O-N 3.3Å; S198-G200 VanDerWaalsContact O-N 3.08Å
199	I	42.5	Very low	37.5	Very low	145 Å²	145	96.1 Å²	96.1	74%	0.744	62%	0.622	S	S	*	*	B	Isolated β-bridge	trans	-79.4	95.8	176.6	-59.1	176.1	0	0	0	107.5	Y191 G201	Y191-I199 HydrophobicContact CD1-CG2 4.23Å; I199-G201 PolarHBondContact O-N 3.16Å
200	G	33.5	Very low	37.8	Very low	38 Å²	38	98.2 Å²	98.2	39%	0.392	62%	0.62	S	S	.	*			trans	-60.6	112.9	176.4	0	0	0	0	0	111.6	S198 G202	S198-G200 PolarHBondContact O-N 3.3Å; S198-G200 VanDerWaalsContact O-N 3.08Å; G200-G202 PolarHBondContact O-N 3.23Å
201	G	32.6	Very low	38.1	Very low	81 Å²	81	95 Å²	95	84%	0.835	60%	0.598	S	S	*	*			trans	-73.4	85.2	-179.2	0	0	0	0	0	113	I199	I199-G201 PolarHBondContact O-N 3.16Å
202	G	33.8	Very low	38.4	Very low	62 Å²	62	88.8 Å²	88.8	64%	0.639	58%	0.577	S	S	*	*			trans	-63.2	151.8	169.6	0	0	0	0	0	112.6	G200	G200-G202 PolarHBondContact O-N 3.23Å
203	P	37.4	Very low	38.9	Very low	99 Å²	99	83.9 Å²	83.9	64%	0.643	56%	0.56	S	S	*	*			trans	-66.3	147.2	-175	26.8	-34.9	0	0	0	112.7	F205	P203-F205 HydrophobicContact CG-CE2 4.47Å; P203-F205 WeakPolarHBondContact O-CD2 3.41Å; P203-F205 PolarHBondContact O-N 3.48Å
204	P	40	Very low	39.3	Very low	110 Å²	110	82.8 Å²	82.8	71%	0.714	56%	0.558	S	S	*	*			trans	-71	104.6	-175.6	28.2	-34.8	0	0	0	111.9
205	F	36.5	Very low	39.9	Very low	178 Å²	178	82.8 Å²	82.8	78%	0.781	57%	0.571	S	S	*	*			trans	-72.4	129	170.9	-77.9	-83.1	0	0	0	111.2	P203 N207	P203-F205 HydrophobicContact CG-CE2 4.47Å; P203-F205 WeakPolarHBondContact O-CD2 3.41Å; P203-F205 PolarHBondContact O-N 3.48Å; F205-N207 PolarHBondContact O-N 3Å
206	S	36.4	Very low	40	Very low	101 Å²	101	84.1 Å²	84.1	71%	0.706	55%	0.551	S	S	*	*			trans	-70.3	104.3	-178.4	-172.4	0	0	0	0	111.4	A208	S206-A208 PolarHBondContact O-N 3.28Å
207	N	38.5	Very low	40.6	Very low	96 Å²	96	86.4 Å²	86.4	51%	0.513	55%	0.55	S	S	.	*			trans	-66.5	69.8	177.4	-93.9	-17.7	0	0	0	112.7	K26 F205	K26-N207 WeakPolarHBondContact CD-O 3.4Å; K26-N207 WeakPolarHBondContact CE-O 3.25Å; K26-N207 VanDerWaalsContact NZ-C 3.26Å; K26-N207 PolarHBondContact NZ-O 3.18Å; F205-N207 PolarHBondContact O-N 3Å
208	A	39.2	Very low	41.3	Very low	31 Å²	31	86.3 Å²	86.3	26%	0.256	54%	0.536	S	S	.	.			trans	-96.1	116.3	159.7	0	0	0	0	0	107.5	S206 W210	S206-A208 PolarHBondContact O-N 3.28Å; A208-W210 VanDerWaalsContact C-N 3.3Å; A208-W210 PolarHBondContact O-N 3.08Å
209	G	42.4	Very low	42.3	Very low	23 Å²	23	91.2 Å²	91.2	24%	0.237	55%	0.55	C	S	.	.			trans	-64.9	85.1	178	0	0	0	0	0	111.8	I211 V220	G209-I211 PolarHBondContact O-N 3.45Å; G209-V220 PolarHBondContact O-N 3.48Å
210	W	43.9	Very low	42.8	Very low	117 Å²	117	85.8 Å²	85.8	44%	0.443	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	91.2	176.7	-69	109.2	0	0	0	110	A208 V212 R217 K219	A208-W210 VanDerWaalsContact C-N 3.3Å; A208-W210 PolarHBondContact O-N 3.08Å; W210-V212 PolarHBondContact O-N 2.9Å; W210-R217 HydrophobicContact CB-CG 4.33Å; W210-R217 HydrophobicContact CD2-CB 4.28Å; W210-R217 HydrophobicContact CD2-CG 4.29Å; W210-R217 HydrophobicContact CE3-CB 3.57Å; W210-R217 HydrophobicContact CE3-CG 4.06Å; W210-R217 HydrophobicContact CG-CG 4.46Å; W210-R217 HydrophobicContact CZ3-CB 3.86Å; W210-R217 WeakPolarHBondContact CZ3-O 3.42Å; W210-K219 HydrophobicContact CE3-CB 4.33Å; W210-K219 HydrophobicContact CH2-CB 4.5Å; W210-K219 HydrophobicContact CZ3-CB 3.98Å
211	I	45	Very low	44	Very low	58 Å²	58	91.2 Å²	91.2	30%	0.297	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	118.3	166.2	-58.6	-167.5	0	0	0	107.6	G209 S213 T218 V220 I225	G209-I211 PolarHBondContact O-N 3.45Å; I211-S213 PolarHBondContact O-N 3.45Å; I211-T218 PolarHBondContact N-O 2.95Å; I211-T218 PolarHBondContact O-N 3.1Å; I211-T218 VanDerWaalsContact O-N 3.12Å; I211-T218 PolarHBondContact O-OG1 2.88Å; I211-V220 HydrophobicContact CB-CB 4.41Å; I211-V220 HydrophobicContact CB-CG2 3.78Å; I211-V220 HydrophobicContact CD1-CB 3.89Å; I211-V220 HydrophobicContact CD1-CG1 3.89Å; I211-V220 HydrophobicContact CD1-CG2 3.88Å; I211-V220 HydrophobicContact CG1-CB 3.95Å; I211-V220 HydrophobicContact CG1-CG1 4.5Å; I211-V220 HydrophobicContact CG1-CG2 3.85Å; I211-I225 HydrophobicContact CD1-CD1 4.31Å; I211-I225 HydrophobicContact CD1-CG1 4.44Å
212	V	44.4	Very low	45.1	Very low	38 Å²	38	91.4 Å²	91.4	23%	0.23	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	82.9	177.7	-176.2	0	0	0	0	109.2	W210 R216 R217 R489	W210-V212 PolarHBondContact O-N 2.9Å; V212-R216 WeakPolarHBondContact CA-O 3.36Å; V212-R217 HydrophobicContact CG2-CG 3.89Å; V212-R489 PolarHBondContact O-NH1 3.23Å
213	S	45.4	Very low	46.4	Very low	52 Å²	52	92.9 Å²	92.9	36%	0.364	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	133	171.5	-79.3	0	0	0	0	110.4	I211 G215 R216	I211-S213 PolarHBondContact O-N 3.45Å; S213-G215 PolarHBondContact O-N 2.92Å; S213-R216 PolarHBondContact N-O 2.9Å; S213-R216 PolarHBondContact O-N 2.9Å
214	G	43.1	Very low	47.3	Very low	71 Å²	71	93.1 Å²	93.1	73%	0.732	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	14.1	176.6	0	0	0	0	0	116.1	R216	G214-R216 VanDerWaalsContact C-N 3.28Å; G214-R216 PolarHBondContact O-N 3.02Å
215	G	47.4	Very low	48.4	Very low	67 Å²	67	90.6 Å²	90.6	69%	0.691	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	-3.1	-173.6	0	0	0	0	0	114.6	S213	S213-G215 PolarHBondContact O-N 2.92Å
216	R	39.3	Very low	49.3	Very low	149 Å²	149	89.7 Å²	89.7	56%	0.562	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	137.5	166.5	-72	-174.1	172.4	-163.7	-4	109.5	V212 S213 G214 T218	V212-R216 WeakPolarHBondContact CA-O 3.36Å; S213-R216 PolarHBondContact N-O 2.9Å; S213-R216 PolarHBondContact O-N 2.9Å; G214-R216 VanDerWaalsContact C-N 3.28Å; G214-R216 PolarHBondContact O-N 3.02Å; R216-T218 PolarHBondContact O-N 3.03Å
217	R	56.7	Low	50.2	Low	167 Å²	167	90.3 Å²	90.3	63%	0.63	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.8	96.1	169.5	-96.8	-174.3	169.8	177.6	-3.6	107.8	W210 V212	W210-R217 HydrophobicContact CB-CG 4.33Å; W210-R217 HydrophobicContact CD2-CB 4.28Å; W210-R217 HydrophobicContact CD2-CG 4.29Å; W210-R217 HydrophobicContact CE3-CB 3.57Å; W210-R217 HydrophobicContact CE3-CG 4.06Å; W210-R217 HydrophobicContact CG-CG 4.46Å; W210-R217 HydrophobicContact CZ3-CB 3.86Å; W210-R217 WeakPolarHBondContact CZ3-O 3.42Å; V212-R217 HydrophobicContact CG2-CG 3.89Å
218	T	52	Low	50.9	Low	68 Å²	68	90.5 Å²	90.5	42%	0.417	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.7	170	32.7	0	0	0	0	109.2	I211 R216 V220	I211-T218 PolarHBondContact N-O 2.95Å; I211-T218 PolarHBondContact O-N 3.1Å; I211-T218 VanDerWaalsContact O-N 3.12Å; I211-T218 PolarHBondContact O-OG1 2.88Å; R216-T218 PolarHBondContact O-N 3.03Å; T218-V220 PolarHBondContact O-N 2.89Å; T218-V220 VanDerWaalsContact O-N 3.11Å
219	K	57.5	Low	51.3	Low	164 Å²	164	95.2 Å²	95.2	71%	0.713	52%	0.517	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	93.5	168.9	-177	-178.8	-179.6	-177.1	0	106.8	W210	W210-K219 HydrophobicContact CE3-CB 4.33Å; W210-K219 HydrophobicContact CH2-CB 4.5Å; W210-K219 HydrophobicContact CZ3-CB 3.98Å
220	V	53.3	Low	51.3	Low	32 Å²	32	97 Å²	97	19%	0.194	54%	0.535	C	S	.	.			trans	-88.9	132.1	176.6	-179.6	0	0	0	0	107	G209 I211 T218 D224 I225	G209-V220 PolarHBondContact O-N 3.48Å; I211-V220 HydrophobicContact CB-CB 4.41Å; I211-V220 HydrophobicContact CB-CG2 3.78Å; I211-V220 HydrophobicContact CD1-CB 3.89Å; I211-V220 HydrophobicContact CD1-CG1 3.89Å; I211-V220 HydrophobicContact CD1-CG2 3.88Å; I211-V220 HydrophobicContact CG1-CB 3.95Å; I211-V220 HydrophobicContact CG1-CG1 4.5Å; I211-V220 HydrophobicContact CG1-CG2 3.85Å; T218-V220 PolarHBondContact O-N 2.89Å; T218-V220 VanDerWaalsContact O-N 3.11Å; V220-D224 HydrophobicContact CG1-CB 3.67Å; V220-I225 HydrophobicContact CG1-CD1 4.44Å; V220-I225 HydrophobicContact CG1-CG1 3.89Å
221	R	59.1	Low	51.3	Low	152 Å²	152	97.2 Å²	97.2	57%	0.574	55%	0.552	S	S	*	*			trans	-82.5	154	179.8	-48.4	-176.4	176.4	-175.1	-1.2	109.7	E223 D224	R221-E223 HydrophobicContact CB-CG 4.19Å; R221-E223 WeakPolarHBondContact CB-OE2 3.32Å; R221-E223 WeakPolarHBondContact CD-OE1 3.48Å; R221-E223 IonicContact CZ-OE1 2.78Å; R221-E223 IonicContact NE-OE1 3.51Å; R221-E223 IonicContact NH1-OE1 3.74Å; R221-E223 PolarHBondContact NH1-OE1 2.93Å; R221-E223 PolarHBondContact O-N 3.41Å; R221-E223 VanDerWaalsContact O-N 3.14Å; R221-D224 WeakPolarHBondContact CB-OD2 3.49Å; R221-D224 WeakPolarHBondContact CG-OD2 3.35Å; R221-D224 PolarHBondContact N-OD2 2.81Å; R221-D224 WeakPolarHBondContact O-CB 3.44Å; R221-D224 PolarHBondContact O-N 3.27Å
222	P	55.8	Low	51	Low	84 Å²	84	99.8 Å²	99.8	55%	0.545	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-56.5	-29.3	179.8	-25.7	35.9	0	0	0	113.7	D224	P222-D224 VanDerWaalsContact C-N 3.34Å
223	E	60.5	Low	50.8	Low	94 Å²	94	103.4 Å²	103.4	44%	0.439	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-72.8	-18.5	175.5	67.4	-92.7	-149.7	0	0	114.9	R221 I225	R221-E223 HydrophobicContact CB-CG 4.19Å; R221-E223 WeakPolarHBondContact CB-OE2 3.32Å; R221-E223 WeakPolarHBondContact CD-OE1 3.48Å; R221-E223 IonicContact CZ-OE1 2.78Å; R221-E223 IonicContact NE-OE1 3.51Å; R221-E223 IonicContact NH1-OE1 3.74Å; R221-E223 PolarHBondContact NH1-OE1 2.93Å; R221-E223 PolarHBondContact O-N 3.41Å; R221-E223 VanDerWaalsContact O-N 3.14Å; E223-I225 VanDerWaalsContact C-N 3.3Å; E223-I225 PolarHBondContact O-N 3.24Å
224	D	57.8	Low	50.4	Low	103 Å²	103	106.2 Å²	106.2	55%	0.551	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-86.4	0.1	-178.4	-61.1	-45.4	0	0	0	112.9	V220 R221 P222	V220-D224 HydrophobicContact CG1-CB 3.67Å; R221-D224 WeakPolarHBondContact CB-OD2 3.49Å; R221-D224 WeakPolarHBondContact CG-OD2 3.35Å; R221-D224 PolarHBondContact N-OD2 2.81Å; R221-D224 WeakPolarHBondContact O-CB 3.44Å; R221-D224 PolarHBondContact O-N 3.27Å; P222-D224 VanDerWaalsContact C-N 3.34Å
225	I	61.7	Low	49.7	Very low	58 Å²	58	109 Å²	109	30%	0.297	62%	0.623	S	S	.	*			trans	-101.9	98.4	-176.6	-54.7	178	0	0	0	109.2	I211 V220 E223 L227	I211-I225 HydrophobicContact CD1-CD1 4.31Å; I211-I225 HydrophobicContact CD1-CG1 4.44Å; V220-I225 HydrophobicContact CG1-CD1 4.44Å; V220-I225 HydrophobicContact CG1-CG1 3.89Å; E223-I225 VanDerWaalsContact C-N 3.3Å; E223-I225 PolarHBondContact O-N 3.24Å; I225-L227 HydrophobicContact CG2-CD2 4.38Å; I225-L227 PolarHBondContact O-N 2.98Å
226	D	55.8	Low	49.2	Very low	158 Å²	158	112.2 Å²	112.2	85%	0.845	63%	0.63	S	S	*	*			trans	-60.2	93.2	168.6	-84	-25.4	0	0	0	110
227	L	54.4	Low	48.8	Very low	114 Å²	114	110.1 Å²	110.1	60%	0.597	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-73.2	142	167.7	-70.2	173.7	0	0	0	109.7	I225	I225-L227 HydrophobicContact CG2-CD2 4.38Å; I225-L227 PolarHBondContact O-N 2.98Å
228	P	53.4	Low	47.6	Very low	101 Å²	101	106.8 Å²	106.8	66%	0.656	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-62.3	144.4	172.2	28.2	-34.2	0	0	0	110	G230	P228-G230 PolarHBondContact O-N 2.99Å
229	P	47.6	Very low	46.6	Very low	130 Å²	130	110.5 Å²	110.5	84%	0.844	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-60.7	124.9	177.5	25.3	-33.4	0	0	0	110.1
230	G	43.9	Very low	45.5	Very low	60 Å²	60	111.7 Å²	111.7	62%	0.619	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-65.5	163.6	173.7	0	0	0	0	0	112.3	P228	P228-G230 PolarHBondContact O-N 2.99Å
231	P	43.5	Very low	44.6	Very low	121 Å²	121	121.8 Å²	121.8	79%	0.786	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-60.7	145.6	175.7	27	-34.3	0	0	0	110.8
232	P	38.6	Very low	43.4	Very low	112 Å²	112	118.5 Å²	118.5	73%	0.727	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-63.8	147.3	176	28.2	-34.7	0	0	0	110.6	S234	P232-S234 PolarHBondContact O-N 3.02Å
233	P	40.8	Very low	42.4	Very low	115 Å²	115	123.8 Å²	123.8	75%	0.747	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-61.8	137.1	178	26.2	-34.3	0	0	0	111	C235	P233-C235 PolarHBondContact O-N 3.11Å; P233-C235 VanDerWaalsContact O-N 3.09Å
234	S	36.4	Very low	41.1	Very low	111 Å²	111	122.7 Å²	122.7	78%	0.776	73%	0.731	S	S	*	*			trans	-61.2	111	179.5	-57.9	0	0	0	0	111.4	P232 T236	P232-S234 PolarHBondContact O-N 3.02Å; S234-T236 VanDerWaalsContact C-N 3.27Å; S234-T236 PolarHBondContact O-N 3.34Å
235	C	28.5	Very low	40.3	Very low	130 Å²	130	125.4 Å²	125.4	88%	0.878	75%	0.745	S	S	*	*			trans	-73.8	69.4	-180	-61.3	0	0	0	0	112.7	P233 S237	P233-C235 PolarHBondContact O-N 3.11Å; P233-C235 VanDerWaalsContact O-N 3.09Å; C235-S237 PolarHBondContact O-N 2.94Å
236	T	35.8	Very low	39.1	Very low	134 Å²	134	130.6 Å²	130.6	82%	0.822	77%	0.768	S	S	*	*			trans	-77.1	113.6	166.4	51.1	0	0	0	0	109.9	S234	S234-T236 VanDerWaalsContact C-N 3.27Å; S234-T236 PolarHBondContact O-N 3.34Å
237	S	32.6	Very low	38.3	Very low	105 Å²	105	130 Å²	130	73%	0.734	76%	0.759	S	S	*	*			trans	-73.5	138.9	-171.8	53.9	0	0	0	0	115.1	C235	C235-S237 PolarHBondContact O-N 2.94Å
238	S	29.7	Very low	37.5	Very low	97 Å²	97	134.9 Å²	134.9	68%	0.678	77%	0.771	S	S	*	*	S	Bend	trans	76.2	134	153.9	88.4	0	0	0	0	120
239	N	33	Very low	36.6	Very low	146 Å²	146	138 Å²	138	78%	0.781	78%	0.779	S	S	*	*			trans	77	35.9	144.9	-57.6	-9.7	0	0	0	121.4
240	H	34.1	Very low	35.9	Very low	188 Å²	188	134.6 Å²	134.6	87%	0.87	77%	0.767	S	S	*	*			trans	-125.1	24.6	168.2	-94.3	13.4	0	0	0	116.9	A242	H240-A242 PolarHBondContact O-N 3.5Å
241	Y	33.1	Very low	35.5	Very low	245 Å²	245	141.8 Å²	141.8	96%	0.961	78%	0.777	S	S	*	*	S	Bend	trans	-83.8	82.1	164.1	-82.2	-90.7	0	0	0	111.3
242	A	35.2	Very low	35.1	Very low	82 Å²	82	140.7 Å²	140.7	68%	0.678	78%	0.778	S	S	*	*	S	Bend	trans	-164.6	-39.7	167.3	0	0	0	0	0	116.5	H240	H240-A242 PolarHBondContact O-N 3.5Å
243	Y	35.3	Very low	34.9	Very low	196 Å²	196	139.6 Å²	139.6	77%	0.769	78%	0.779	S	S	*	*	S	Bend	trans	-97.8	-1.6	-156.9	-88.5	-87.1	0	0	0	117.4	L245	Y243-L245 PolarHBondContact O-N 3.23Å
244	G	33.1	Very low	34.4	Very low	71 Å²	71	143.3 Å²	143.3	73%	0.732	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-15.4	-172.1	0	0	0	0	0	117
245	L	39.6	Very low	34.3	Very low	160 Å²	160	142.8 Å²	142.8	84%	0.838	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-14	-164.4	-150.3	72.4	0	0	0	115.3	Y243	Y243-L245 PolarHBondContact O-N 3.23Å
246	Q	37.7	Very low	34.8	Very low	167 Å²	167	143 Å²	143	78%	0.78	79%	0.787	S	S	*	*	S	Bend	trans	-94	-17.2	-176.3	-80.8	-176.2	-28	0	0	114.9
247	H	38.4	Very low	34.7	Very low	146 Å²	146	145 Å²	145	68%	0.676	79%	0.787	S	S	*	*	S	Bend	trans	-89.5	-13.9	-174.7	-78	-86.5	0	0	0	114.9
248	Y	36.9	Very low	35.2	Very low	216 Å²	216	146.2 Å²	146.2	85%	0.847	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-9	-176.3	-143.4	-97.7	0	0	0	114.6
249	M	35.9	Very low	36.1	Very low	166 Å²	166	148.9 Å²	148.9	82%	0.818	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	-3.2	178.3	-68.7	-111.8	62.5	0	0	113.9
250	G	32.7	Very low	36.5	Very low	58 Å²	58	152.9 Å²	152.9	60%	0.598	79%	0.791	S	S	*	*	S	Bend	trans	-92.4	-18.2	-171.9	0	0	0	0	0	116.8
251	Y	35.6	Very low	36.9	Very low	212 Å²	212	146.9 Å²	146.9	83%	0.831	78%	0.779	S	S	*	*	S	Bend	trans	-112.5	-1.5	-168.7	-75.4	-80.1	0	0	0	115.3	A253	Y251-A253 VanDerWaalsContact C-N 3.26Å; Y251-A253 PolarHBondContact O-N 3.46Å
252	A	34.1	Very low	37.6	Very low	97 Å²	97	142.7 Å²	142.7	80%	0.802	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	11.5	179.7	0	0	0	0	0	114.5
253	A	33.7	Very low	38.4	Very low	90 Å²	90	143.6 Å²	143.6	74%	0.744	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	-0.3	-169.2	0	0	0	0	0	115.4	Y251	Y251-A253 VanDerWaalsContact C-N 3.26Å; Y251-A253 PolarHBondContact O-N 3.46Å
254	Q	31.4	Very low	39.1	Very low	192 Å²	192	137 Å²	137	90%	0.897	75%	0.749	S	S	*	*			trans	-141.2	77.9	-177.8	-78.3	-176.8	-30.4	0	0	112.6
255	A	34.1	Very low	40.4	Very low	101 Å²	101	136.6 Å²	136.6	84%	0.835	74%	0.735	S	S	*	*			trans	-143.8	125.6	158	0	0	0	0	0	108.5
256	T	38.8	Very low	41.7	Very low	135 Å²	135	131 Å²	131	83%	0.828	71%	0.712	S	S	*	*			trans	-80.6	138	-161.4	39.4	0	0	0	0	114.5	D258	T256-D258 PolarHBondContact O-N 3.26Å
257	E	34.3	Very low	43.2	Very low	176 Å²	176	125.8 Å²	125.8	82%	0.822	69%	0.694	S	S	*	*			trans	-58	111.2	170.1	177.8	-178.4	177.6	0	0	112.1
258	D	42.4	Very low	44.8	Very low	129 Å²	129	123.5 Å²	123.5	69%	0.69	69%	0.686	S	S	*	*			trans	-143.3	108.5	173.4	-113.7	-35.2	0	0	0	116	T256 R260	T256-D258 PolarHBondContact O-N 3.26Å; D258-R260 VanDerWaalsContact C-N 3.34Å; D258-R260 PolarHBondContact O-N 3.4Å
259	Q	48.5	Very low	46.8	Very low	154 Å²	154	117.8 Å²	117.8	72%	0.72	67%	0.673	S	S	*	*	S	Bend	trans	42.7	-25.6	157.4	-54.6	-156.6	17.4	0	0	124	G261 K262	Q259-G261 VanDerWaalsContact C-N 3.32Å; Q259-G261 PolarHBondContact O-N 3.08Å; Q259-K262 PolarHBondContact O-N 3.43Å
260	R	40.9	Very low	48.8	Very low	230 Å²	230	118.7 Å²	118.7	87%	0.868	67%	0.667	S	S	*	*	H	α-helix	trans	-64.9	-26.7	-172	-101.2	-176.8	174.4	-169.4	-0.8	115.3	D258 K262 T263	D258-R260 VanDerWaalsContact C-N 3.34Å; D258-R260 PolarHBondContact O-N 3.4Å; R260-K262 PolarHBondContact O-N 3.07Å; R260-T263 PolarHBondContact O-OG1 3.01Å
261	G	42.6	Very low	50.9	Low	61 Å²	61	121.5 Å²	121.5	63%	0.629	67%	0.665	S	S	*	*	H	α-helix	trans	-72.6	-20.5	180	0	0	0	0	0	115.5	Q259 S265	Q259-G261 VanDerWaalsContact C-N 3.32Å; Q259-G261 PolarHBondContact O-N 3.08Å; G261-S265 PolarHBondContact O-OG 3.49Å
262	K	48.2	Very low	53	Low	157 Å²	157	116.9 Å²	116.9	68%	0.683	65%	0.654	S	S	*	*	H	α-helix	trans	-83.5	-19.7	-173.9	-67.6	176.1	-178	169.1	0	113.3	Q259 R260 S265	Q259-K262 PolarHBondContact O-N 3.43Å; R260-K262 PolarHBondContact O-N 3.07Å; K262-S265 PolarHBondContact O-OG 3.02Å
263	T	51.3	Low	55.4	Low	102 Å²	102	120.1 Å²	120.1	63%	0.626	65%	0.65	S	S	*	*	H	α-helix	trans	-90.7	-39.1	179.2	53.1	0	0	0	0	113	R260 A266 S267	R260-T263 PolarHBondContact O-OG1 3.01Å; T263-A266 PolarHBondContact O-N 3.15Å; T263-S267 PolarHBondContact O-N 3.46Å; T263-S267 VanDerWaalsContact O-N 3.11Å
264	A	50.4	Low	57.7	Low	56 Å²	56	122.1 Å²	122.1	46%	0.463	64%	0.644	S	S	.	*	H	α-helix	trans	-63.8	-43.9	176.8	0	0	0	0	0	112.3	S267 I268	A264-S267 WeakPolarHBondContact O-CB 3.26Å; A264-S267 PolarHBondContact O-N 3.12Å; A264-I268 PolarHBondContact O-N 3.2Å
265	S	61.2	Low	59.8	Low	64 Å²	64	120.3 Å²	120.3	45%	0.448	63%	0.634	S	S	.	*	H	α-helix	trans	-61.2	-43.4	175	47.4	0	0	0	0	112.4	G261 K262 S267 I268 V269	G261-S265 PolarHBondContact O-OG 3.49Å; K262-S265 PolarHBondContact O-OG 3.02Å; S265-S267 VanDerWaalsContact C-N 3.31Å; S265-S267 PolarHBondContact O-N 3.01Å; S265-I268 PolarHBondContact O-N 2.85Å; S265-V269 WeakPolarHBondContact O-CG2 3.39Å; S265-V269 PolarHBondContact O-N 2.75Å; S265-V269 VanDerWaalsContact O-N 3.08Å
266	A	66.4	Low	61.8	Low	42 Å²	42	118.1 Å²	118.1	35%	0.347	62%	0.615	S	S	.	*	H	α-helix	trans	-63.2	-33.4	175.8	0	0	0	0	0	113.4	T263 R270	T263-A266 PolarHBondContact O-N 3.15Å; A266-R270 WeakPolarHBondContact O-CG 3.45Å; A266-R270 PolarHBondContact O-N 3.5Å
267	S	70.5	Confident	63.5	Low	58 Å²	58	115.4 Å²	115.4	41%	0.406	60%	0.602	S	S	.	*	H	α-helix	trans	-65	-51.4	174.8	-175.3	0	0	0	0	111.8	T263 A264 S265 V269 R270 Q271	T263-S267 PolarHBondContact O-N 3.46Å; T263-S267 VanDerWaalsContact O-N 3.11Å; A264-S267 WeakPolarHBondContact O-CB 3.26Å; A264-S267 PolarHBondContact O-N 3.12Å; S265-S267 VanDerWaalsContact C-N 3.31Å; S265-S267 PolarHBondContact O-N 3.01Å; S267-V269 VanDerWaalsContact C-N 3.33Å; S267-V269 PolarHBondContact O-N 2.99Å; S267-R270 WeakPolarHBondContact O-CB 3.26Å; S267-R270 PolarHBondContact O-N 3.26Å; S267-R270 VanDerWaalsContact O-N 3.12Å; S267-Q271 PolarHBondContact O-N 2.81Å
268	I	71.8	Confident	65.2	Low	97 Å²	97	112.9 Å²	112.9	50%	0.497	59%	0.593	S	S	.	*	H	α-helix	trans	-61.9	-40.7	-179	-67.6	159.9	0	0	0	111.1	A264 S265 R270 Q271 L272	A264-I268 PolarHBondContact O-N 3.2Å; S265-I268 PolarHBondContact O-N 2.85Å; I268-R270 VanDerWaalsContact C-N 3.34Å; I268-R270 PolarHBondContact O-N 3Å; I268-Q271 PolarHBondContact O-N 3.05Å; I268-L272 HydrophobicContact CG2-CD1 3.92Å; I268-L272 HydrophobicContact CG2-CG 4.46Å; I268-L272 WeakPolarHBondContact O-CG 3.31Å; I268-L272 PolarHBondContact O-N 3.49Å
269	V	78	Confident	66.6	Low	96 Å²	96	114.4 Å²	114.4	58%	0.582	59%	0.594	S	S	*	*	H	α-helix	trans	-63.2	-37.2	176.2	171.7	0	0	0	0	112.1	S265 S267 K273	S265-V269 WeakPolarHBondContact O-CG2 3.39Å; S265-V269 PolarHBondContact O-N 2.75Å; S265-V269 VanDerWaalsContact O-N 3.08Å; S267-V269 VanDerWaalsContact C-N 3.33Å; S267-V269 PolarHBondContact O-N 2.99Å; V269-K273 WeakPolarHBondContact O-CB 3.43Å; V269-K273 PolarHBondContact O-N 3Å; V269-K273 VanDerWaalsContact O-N 3.08Å
270	R	77.7	Confident	67.2	Low	185 Å²	185	113.4 Å²	113.4	70%	0.698	59%	0.589	S	S	*	*	H	α-helix	trans	-66.1	-44	174	-71.3	175.8	-164.9	173.8	5.5	111.8	A266 S267 I268 K273 Q274	A266-R270 WeakPolarHBondContact O-CG 3.45Å; A266-R270 PolarHBondContact O-N 3.5Å; S267-R270 WeakPolarHBondContact O-CB 3.26Å; S267-R270 PolarHBondContact O-N 3.26Å; S267-R270 VanDerWaalsContact O-N 3.12Å; I268-R270 VanDerWaalsContact C-N 3.34Å; I268-R270 PolarHBondContact O-N 3Å; R270-K273 PolarHBondContact O-N 3.07Å; R270-Q274 WeakPolarHBondContact O-CG 3.34Å; R270-Q274 PolarHBondContact O-N 3.1Å
271	Q	77.5	Confident	68.1	Low	118 Å²	118	112.9 Å²	112.9	55%	0.551	59%	0.587	S	S	*	*	H	α-helix	trans	-63.5	-44.4	178.8	-70.2	-179.4	-10	0	0	111.9	S267 I268 K273 Q274 F275	S267-Q271 PolarHBondContact O-N 2.81Å; I268-Q271 PolarHBondContact O-N 3.05Å; Q271-K273 VanDerWaalsContact C-N 3.34Å; Q271-K273 PolarHBondContact O-N 3.45Å; Q271-Q274 PolarHBondContact O-N 3.37Å; Q271-F275 PolarHBondContact O-N 2.92Å
272	L	79.8	Confident	68.6	Low	115 Å²	115	118.8 Å²	118.8	60%	0.602	60%	0.595	S	S	*	*	H	α-helix	trans	-61.2	-40.6	174.8	-75.5	167.9	0	0	0	112.2	I268 F275 A276	I268-L272 HydrophobicContact CG2-CD1 3.92Å; I268-L272 HydrophobicContact CG2-CG 4.46Å; I268-L272 WeakPolarHBondContact O-CG 3.31Å; I268-L272 PolarHBondContact O-N 3.49Å; L272-F275 PolarHBondContact O-N 2.9Å; L272-A276 PolarHBondContact O-N 3.21Å
273	K	83.7	Confident	68.9	Low	164 Å²	164	118.3 Å²	118.3	71%	0.713	60%	0.595	S	S	*	*	H	α-helix	trans	-66.3	-37.3	176.9	-164.9	170.8	-174.8	175.3	0	112.3	V269 R270 Q271 S277	V269-K273 WeakPolarHBondContact O-CB 3.43Å; V269-K273 PolarHBondContact O-N 3Å; V269-K273 VanDerWaalsContact O-N 3.08Å; R270-K273 PolarHBondContact O-N 3.07Å; Q271-K273 VanDerWaalsContact C-N 3.34Å; Q271-K273 PolarHBondContact O-N 3.45Å; K273-S277 PolarHBondContact O-N 3.44Å; K273-S277 PolarHBondContact O-OG 3.4Å
274	Q	82.2	Confident	69.1	Low	132 Å²	132	120.6 Å²	120.6	62%	0.617	60%	0.604	S	S	*	*	H	α-helix	trans	-63.1	-44.9	171.3	-74.5	176.9	-25.8	0	0	111.4	R270 Q271 A276 S277 L278	R270-Q274 WeakPolarHBondContact O-CG 3.34Å; R270-Q274 PolarHBondContact O-N 3.1Å; Q271-Q274 PolarHBondContact O-N 3.37Å; Q274-A276 PolarHBondContact O-N 3.12Å; Q274-S277 PolarHBondContact O-N 3.37Å; Q274-S277 PolarHBondContact O-OG 3.43Å; Q274-L278 PolarHBondContact O-N 2.93Å
275	F	76	Confident	68.8	Low	155 Å²	155	121 Å²	121	68%	0.68	61%	0.614	S	S	*	*	H	α-helix	trans	-63.8	-41.6	179.6	-134	-87.5	0	0	0	112.9	Q271 L272 L278 K279	Q271-F275 PolarHBondContact O-N 2.92Å; L272-F275 PolarHBondContact O-N 2.9Å; F275-L278 PolarHBondContact O-N 3.45Å; F275-K279 PolarHBondContact O-N 3.37Å; F275-K279 VanDerWaalsContact O-N 3.09Å
276	A	76	Confident	67.9	Low	55 Å²	55	122.6 Å²	122.6	46%	0.455	63%	0.63	S	S	.	*	H	α-helix	trans	-61.9	-43.4	175.5	0	0	0	0	0	112.3	L272 Q274 L278 K279 H280	L272-A276 PolarHBondContact O-N 3.21Å; Q274-A276 PolarHBondContact O-N 3.12Å; A276-L278 VanDerWaalsContact C-N 3.31Å; A276-L278 PolarHBondContact O-N 3.37Å; A276-K279 PolarHBondContact O-N 3.4Å; A276-H280 PolarHBondContact O-N 3.03Å
277	S	73.5	Confident	67.1	Low	77 Å²	77	128.1 Å²	128.1	54%	0.538	66%	0.66	S	S	.	*	H	α-helix	trans	-67.6	-28.8	176.3	63.6	0	0	0	0	113.6	K273 Q274	K273-S277 PolarHBondContact O-N 3.44Å; K273-S277 PolarHBondContact O-OG 3.4Å; Q274-S277 PolarHBondContact O-N 3.37Å; Q274-S277 PolarHBondContact O-OG 3.43Å
278	L	70.9	Confident	65.8	Low	124 Å²	124	129 Å²	129	65%	0.649	68%	0.678	S	S	*	*	H	α-helix	trans	-72	-34.9	174	-148.1	78.5	0	0	0	112	Q274 F275 A276 R281	Q274-L278 PolarHBondContact O-N 2.93Å; F275-L278 PolarHBondContact O-N 3.45Å; A276-L278 VanDerWaalsContact C-N 3.31Å; A276-L278 PolarHBondContact O-N 3.37Å; L278-R281 PolarHBondContact O-N 3.12Å
279	K	71	Confident	64.5	Low	160 Å²	160	132 Å²	132	70%	0.696	70%	0.695	S	S	*	*	H	α-helix	trans	-68.2	-48.5	-178.9	-148.5	-170.2	-177.5	-161.3	0	112	F275 A276 R281 K282	F275-K279 PolarHBondContact O-N 3.37Å; F275-K279 VanDerWaalsContact O-N 3.09Å; A276-K279 PolarHBondContact O-N 3.4Å; K279-R281 PolarHBondContact O-N 2.91Å; K279-K282 PolarHBondContact O-N 2.89Å; K279-K282 VanDerWaalsContact O-N 3.07Å
280	H	62	Low	63.1	Low	133 Å²	133	132.9 Å²	132.9	62%	0.616	71%	0.706	S	S	*	*	H	α-helix	trans	-63	-23.2	177.3	-78.2	-63.9	0	0	0	114	A276 K282	A276-H280 PolarHBondContact O-N 3.03Å; H280-K282 VanDerWaalsContact C-N 3.33Å
281	R	58.5	Low	61.3	Low	219 Å²	219	128.1 Å²	128.1	83%	0.826	71%	0.714	S	S	*	*	H	α-helix	trans	-79.4	-13.8	176.9	-156.6	174.5	-178.2	-171.2	0.3	113.6	L278 K279	L278-R281 PolarHBondContact O-N 3.12Å; K279-R281 PolarHBondContact O-N 2.91Å
282	K	55	Low	59.5	Low	186 Å²	186	126.4 Å²	126.4	81%	0.809	73%	0.728	S	S	*	*	H	α-helix	trans	-91.2	-17.8	178.1	-167	171.9	178.8	-177.4	0	113.5	K279 H280	K279-K282 PolarHBondContact O-N 2.89Å; K279-K282 VanDerWaalsContact O-N 3.07Å; H280-K282 VanDerWaalsContact C-N 3.33Å
283	E	54.2	Low	57.8	Low	146 Å²	146	125.7 Å²	125.7	68%	0.682	73%	0.733	S	S	*	*	H	α-helix	trans	-94.4	-18.9	-173.1	-150.8	155.1	-150.2	0	0	113.3
284	N	54.9	Low	55.9	Low	150 Å²	150	124.3 Å²	124.3	80%	0.802	73%	0.733	S	S	*	*	S	Bend	trans	-106.3	30.2	-177.7	-69.1	-17.4	0	0	0	113.9
285	G	44.9	Very low	53.9	Low	66 Å²	66	125.3 Å²	125.3	68%	0.68	74%	0.738	S	S	*	*			trans	-143	47.3	-168.4	0	0	0	0	0	115.1
286	A	40.6	Very low	52.5	Low	96 Å²	96	123 Å²	123	79%	0.793	74%	0.737	S	S	*	*			trans	-145	43.8	-174.5	0	0	0	0	0	114.9
287	V	49.6	Very low	50.9	Low	158 Å²	158	128.1 Å²	128.1	96%	0.958	76%	0.756	S	S	*	*			trans	-143.7	125.9	163.1	-174.8	0	0	0	0	108.6
288	G	44.3	Very low	49.3	Very low	77 Å²	77	130 Å²	130	79%	0.794	77%	0.769	S	S	*	*			trans	148.7	61.4	176.8	0	0	0	0	0	114.6
289	D	44	Very low	48.1	Very low	161 Å²	161	130.3 Å²	130.3	86%	0.861	78%	0.779	S	S	*	*			trans	-99.9	113.1	167.8	-173	14.4	0	0	0	109.4
290	S	48.4	Very low	46.5	Very low	114 Å²	114	126 Å²	126	80%	0.797	78%	0.78	S	S	*	*			trans	-178.9	132.9	159.8	22	0	0	0	0	109.7
291	G	40.6	Very low	45.5	Very low	84 Å²	84	124.3 Å²	124.3	87%	0.866	79%	0.789	S	S	*	*			trans	-82.3	161.9	-176.5	0	0	0	0	0	114.4
292	G	39.1	Very low	44.9	Very low	83 Å²	83	125 Å²	125	86%	0.856	79%	0.794	S	S	*	*			trans	-170.9	130.6	173.5	0	0	0	0	0	110.2
293	S	43.9	Very low	44.2	Very low	100 Å²	100	121 Å²	121	70%	0.699	79%	0.789	S	S	*	*			trans	-90.9	151.7	-168	52.4	0	0	0	0	114.4
294	N	44.2	Very low	43.8	Very low	135 Å²	135	122.1 Å²	122.1	72%	0.722	80%	0.799	S	S	*	*			trans	65.5	154.4	153.2	-63.1	18.6	0	0	0	115.7
295	E	41	Very low	43.1	Very low	152 Å²	152	122.7 Å²	122.7	71%	0.71	80%	0.796	S	S	*	*			cis	-155.7	161.3	-0.4	-124.4	156.3	-133.3	0	0	109.6
296	T	46.6	Very low	43.3	Very low	108 Å²	108	128.5 Å²	128.5	66%	0.663	80%	0.803	S	S	*	*			trans	16.5	121.2	157.8	59.8	0	0	0	0	121.2
297	N	42.1	Very low	43.5	Very low	161 Å²	161	133.3 Å²	133.3	86%	0.861	81%	0.806	S	S	*	*				-179.1	160.2	100.4	-93.1	-43.5	0	0	0	114.5
298	S	39.8	Very low	43.5	Very low	117 Å²	117	129.4 Å²	129.4	82%	0.818	79%	0.791	S	S	*	*			trans	-89.7	167.5	-172.5	-89.9	0	0	0	0	114.4
299	P	44.8	Very low	43.7	Very low	130 Å²	130	133.8 Å²	133.8	84%	0.844	79%	0.79	S	S	*	*			trans	-93.3	161.7	-156.5	36.7	-36.9	0	0	0	115.2
300	G	38.6	Very low	43.8	Very low	71 Å²	71	132.1 Å²	132.1	73%	0.732	78%	0.781	S	S	*	*			trans	-137.9	134.8	169.9	0	0	0	0	0	111.6
301	A	40.8	Very low	43.8	Very low	97 Å²	97	132.9 Å²	132.9	80%	0.802	77%	0.772	S	S	*	*			trans	-100.8	142.8	177.1	0	0	0	0	0	110.8
302	Y	46.2	Very low	44	Very low	234 Å²	234	137.1 Å²	137.1	92%	0.918	77%	0.767	S	S	*	*			trans	-135.4	131.4	165.5	-75.1	-77.3	0	0	0	111.2
303	S	38.9	Very low	44.2	Very low	102 Å²	102	138.4 Å²	138.4	71%	0.713	76%	0.758	S	S	*	*			trans	-99.6	148	171.4	172.3	0	0	0	0	109.2
304	L	45.4	Very low	44.1	Very low	168 Å²	168	139.2 Å²	139.2	88%	0.88	76%	0.755	S	S	*	*			trans	-158.8	140.1	148.9	-130.9	126	0	0	0	113.9
305	E	40.6	Very low	44.1	Very low	162 Å²	162	140.3 Å²	140.3	76%	0.757	76%	0.755	S	S	*	*			trans	-94.3	164.7	-175.5	-54.4	162.4	96.7	0	0	114
306	K	49.9	Very low	44.1	Very low	189 Å²	189	138.9 Å²	138.9	82%	0.822	76%	0.757	S	S	*	*			trans	-171.7	118.6	137.8	-99.3	154.1	-176.3	-179	0	108
307	K	45.5	Very low	43.9	Very low	196 Å²	196	137.5 Å²	137.5	85%	0.852	76%	0.756	S	S	*	*				60.4	134.3	81.1	-80.5	-172.1	173.5	-179.5	0	113.3
308	A	49	Very low	43.8	Very low	77 Å²	77	135.7 Å²	135.7	64%	0.636	75%	0.752	S	S	*	*			cis	-171	164.2	9.4	0	0	0	0	0	114.1
309	Q	47.6	Very low	43.8	Very low	168 Å²	168	135.5 Å²	135.5	79%	0.785	75%	0.745	S	S	*	*			trans	68.6	121.2	147.9	-74.3	-170.9	-79.5	0	0	120.6
310	D	46.6	Very low	43.8	Very low	126 Å²	126	136.3 Å²	136.3	67%	0.674	74%	0.738	S	S	*	*				93.2	150	86.8	-79.3	-27	0	0	0	111.2
311	E	48.2	Very low	43.9	Very low	131 Å²	131	141 Å²	141	61%	0.612	74%	0.741	S	S	*	*			cis	-159	150.7	3.4	-126.5	-167.3	150.1	0	0	108.8
312	K	44.5	Very low	44	Very low	172 Å²	172	139.4 Å²	139.4	75%	0.748	73%	0.734	S	S	*	*			trans	52.2	158.2	139	-71.8	-178	-176.2	156.5	0	121.7
313	V	44.5	Very low	44	Very low	110 Å²	110	136.8 Å²	136.8	67%	0.667	73%	0.73	S	S	*	*			cis	-169.1	150.8	-6.8	122.4	0	0	0	0	110.5
314	D	41.4	Very low	44.3	Very low	118 Å²	118	138.1 Å²	138.1	63%	0.631	73%	0.729	S	S	*	*			trans	52.8	128.9	154.3	-66.1	-22.9	0	0	0	123.6
315	Q	44.9	Very low	44.2	Very low	157 Å²	157	133.8 Å²	133.8	73%	0.734	72%	0.717	S	S	*	*				62.6	135.7	94.9	-55.3	177.8	59.6	0	0	113.9
316	T	40.7	Very low	44.5	Very low	123 Å²	123	134.1 Å²	134.1	76%	0.755	72%	0.724	S	S	*	*			cis	-167.1	147.9	24.6	4.6	0	0	0	0	111.8
317	A	41.2	Very low	43.9	Very low	78 Å²	78	129 Å²	129	65%	0.645	73%	0.725	S	S	*	*				60.7	130.9	128.6	0	0	0	0	0	125.8
318	T	40.3	Very low	43.7	Very low	124 Å²	124	128.3 Å²	128.3	76%	0.761	73%	0.727	S	S	*	*			trans	72.4	111.5	132.5	46.8	0	0	0	0	124.4
319	T	40.1	Very low	43.8	Very low	112 Å²	112	129.2 Å²	129.2	69%	0.687	73%	0.727	S	S	*	*				104.5	136.9	110.3	-63.6	0	0	0	0	122.4
320	Q	44.5	Very low	43.5	Very low	147 Å²	147	125.9 Å²	125.9	69%	0.687	72%	0.722	S	S	*	*			trans	88.9	127.9	153	-93.5	169.3	-49.6	0	0	123.8
321	E	42.3	Very low	43.3	Very low	171 Å²	171	125.6 Å²	125.6	80%	0.799	73%	0.725	S	S	*	*			trans	55.3	142.4	139.3	-71.3	156.6	-153.5	0	0	120.8
322	G	41.5	Very low	43.1	Very low	63 Å²	63	125.8 Å²	125.8	65%	0.649	73%	0.725	S	S	*	*			cis	169.7	166.1	-3.4	0	0	0	0	0	111.3
323	E	46.6	Very low	43.1	Very low	179 Å²	179	124.5 Å²	124.5	84%	0.836	72%	0.72	S	S	*	*			trans	61.8	157.9	157.9	-56.3	-156.9	135.3	0	0	119.2
324	N	45.1	Very low	43.2	Very low	130 Å²	130	126.6 Å²	126.6	70%	0.695	73%	0.728	S	S	*	*			cis	-158.7	151.4	-24.1	-111.5	-34	0	0	0	111.1
325	A	44.1	Very low	43.1	Very low	76 Å²	76	129.7 Å²	129.7	63%	0.628	74%	0.738	S	S	*	*			trans	66.4	143.2	141.5	0	0	0	0	0	125
326	N	45.2	Very low	43.3	Very low	169 Å²	169	130.6 Å²	130.6	90%	0.904	75%	0.747	S	S	*	*			trans	98.8	127.5	145.8	-60.4	-36.3	0	0	0	121.6
327	G	38.7	Very low	43.3	Very low	81 Å²	81	133.5 Å²	133.5	84%	0.835	75%	0.749	S	S	*	*			trans	135.3	91	157.5	0	0	0	0	0	115.2
328	M	40.2	Very low	43.2	Very low	182 Å²	182	136.5 Å²	136.5	90%	0.897	75%	0.754	S	S	*	*			trans	-120.6	-168.1	177.8	-148.9	-148.1	170	0	0	111.7
329	P	50.7	Low	43.2	Very low	97 Å²	97	137.7 Å²	137.7	63%	0.63	76%	0.755	S	S	*	*				-109.2	-174.6	-113.8	44.5	-30.9	0	0	0	114.7
330	S	42.7	Very low	43.2	Very low	98 Å²	98	136 Å²	136	69%	0.685	75%	0.752	S	S	*	*			trans	174.6	141.9	134.6	45.5	0	0	0	0	115.1
331	T	42	Very low	43	Very low	120 Å²	120	135.4 Å²	135.4	74%	0.736	75%	0.753	S	S	*	*			trans	56.7	152.2	141	55.5	0	0	0	0	121.3
332	E	43.1	Very low	43.1	Very low	134 Å²	134	135 Å²	135	63%	0.626	75%	0.749	S	S	*	*			cis	-164.1	159.8	0.4	-120.8	-178.4	-179.7	0	0	111.2
333	K	44.6	Very low	43.3	Very low	146 Å²	146	137.3 Å²	137.3	64%	0.635	75%	0.746	S	S	*	*			trans	45.5	130.8	142.2	-69.6	168.8	-165.3	153	0	120.3
334	N	48.1	Very low	43.8	Very low	154 Å²	154	135.5 Å²	135.5	82%	0.824	74%	0.742	S	S	*	*				-174.8	157.9	54.9	-108.6	-22.9	0	0	0	112.1
335	E	39.1	Very low	44	Very low	183 Å²	183	135.5 Å²	135.5	86%	0.855	74%	0.742	S	S	*	*			trans	-77.4	159.1	167.6	-54.2	-179.2	124.4	0	0	112.6
336	L	48.6	Very low	44.1	Very low	176 Å²	176	137.9 Å²	137.9	92%	0.921	75%	0.749	S	S	*	*			trans	-165	170.8	133	-107.2	170.2	0	0	0	112.1
337	K	40.3	Very low	44.2	Very low	183 Å²	183	135.1 Å²	135.1	80%	0.796	74%	0.74	S	S	*	*			trans	-132.3	167.9	-149.1	-136.1	173.7	-166.9	168.1	0	111.1
338	L	39	Very low	44.9	Very low	141 Å²	141	137 Å²	137	74%	0.738	74%	0.741	S	S	*	*			trans	99.8	122.6	152.3	-63.1	144	0	0	0	121.7
339	L	41.2	Very low	44.6	Very low	150 Å²	150	137.8 Å²	137.8	79%	0.785	74%	0.739	S	S	*	*			trans	81.1	110.5	131.9	-67.8	170.9	0	0	0	123.6
340	A	39.1	Very low	44.6	Very low	75 Å²	75	143.1 Å²	143.1	62%	0.62	75%	0.753	S	S	*	*				56.1	136.5	115.9	0	0	0	0	0	119.9
341	N	41.7	Very low	44.3	Very low	136 Å²	136	149.4 Å²	149.4	73%	0.727	76%	0.761	S	S	*	*				175.1	154.1	66.8	-115.2	-32.6	0	0	0	112.6
342	K	43.9	Very low	44.3	Very low	163 Å²	163	148.6 Å²	148.6	71%	0.709	77%	0.766	S	S	*	*			trans	69.1	156	142.1	-66.2	-175.1	155.5	-139.3	0	121.1
343	D	45.6	Very low	44	Very low	111 Å²	111	147 Å²	147	59%	0.594	77%	0.771	S	S	*	*			cis	-161.9	-179.3	-14.9	-103.4	-20.9	0	0	0	109
344	D	56.1	Low	43.7	Very low	140 Å²	140	148 Å²	148	75%	0.749	78%	0.782	S	S	*	*			trans	83.1	139.3	154	-71.2	-40.3	0	0	0	121.7
345	N	49.4	Very low	43.1	Very low	130 Å²	130	149 Å²	149	70%	0.695	78%	0.781	S	S	*	*			cis	-168.3	172	-19.2	-152.3	-41.3	0	0	0	112.2
346	V	46.7	Very low	43.2	Very low	126 Å²	126	151.4 Å²	151.4	76%	0.764	78%	0.783	S	S	*	*			trans	96.7	116.2	155.1	-161.6	0	0	0	0	120
347	P	46.6	Very low	42.7	Very low	112 Å²	112	147.9 Å²	147.9	73%	0.727	77%	0.773	S	S	*	*			trans	-116.6	174.7	176.2	42.6	-33.8	0	0	0	114.7
348	S	54.1	Low	42.5	Very low	120 Å²	120	144.8 Å²	144.8	84%	0.839	77%	0.774	S	S	*	*			trans	-154.3	141.1	144.6	91.6	0	0	0	0	113.7
349	F	35.1	Very low	42.5	Very low	198 Å²	198	144.3 Å²	144.3	87%	0.868	78%	0.777	S	S	*	*			trans	-109	149.6	173.5	-106	-97.1	0	0	0	109.7
350	K	50	Low	42.2	Very low	210 Å²	210	141.9 Å²	141.9	91%	0.913	77%	0.772	S	S	*	*			trans	-158.8	134	139.8	-115.9	163.7	-173.4	178	0	114.1
351	R	36.3	Very low	42.3	Very low	230 Å²	230	143.2 Å²	143.2	87%	0.868	78%	0.778	S	S	*	*			trans	-65	149.8	172.7	-77.4	168	157.6	156.5	-8.9	111.9
352	A	41.7	Very low	42.1	Very low	102 Å²	102	144.6 Å²	144.6	84%	0.843	78%	0.78	S	S	*	*			trans	-144.4	111	137.2	0	0	0	0	0	109.2
353	S	36.1	Very low	41.7	Very low	102 Å²	102	142.3 Å²	142.3	71%	0.713	78%	0.784	S	S	*	*			trans	-81.7	143.5	164.8	-53.6	0	0	0	0	108.7
354	L	39.9	Very low	41.7	Very low	165 Å²	165	141.7 Å²	141.7	86%	0.864	78%	0.784	S	S	*	*			trans	-144.3	123.5	150.4	-149.7	80.7	0	0	0	111.1
355	E	35.3	Very low	40.9	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	79%	0.79	S	S	*	*			trans	-77.8	147.2	176.2	-55.6	169.8	139	0	0	110.8
356	R	40.8	Very low	41	Very low	233 Å²	233	145.2 Å²	145.2	88%	0.879	80%	0.795	S	S	*	*			trans	178.9	134.9	151.2	-98.8	147.4	-173.6	-112.8	0.8	107.8
357	S	38.6	Very low	40.7	Very low	103 Å²	103	144.7 Å²	144.7	72%	0.72	80%	0.796	S	S	*	*			cis	174.3	128	-14.5	38.5	0	0	0	0	104
358	S	34.7	Very low	40.7	Very low	118 Å²	118	149.3 Å²	149.3	83%	0.825	81%	0.805	S	S	*	*			trans	-65.8	142.4	-176.9	49.6	0	0	0	0	115.6
359	V	39.7	Very low	40	Very low	130 Å²	130	148.3 Å²	148.3	79%	0.788	80%	0.804	S	S	*	*			trans	-160	119	148.9	-104	0	0	0	0	107
360	S	35.5	Very low	40.7	Very low	99 Å²	99	144.7 Å²	144.7	69%	0.692	80%	0.803	S	S	*	*				54.4	133.9	96.2	77.1	0	0	0	0	113.6
361	S	40.2	Very low	40.4	Very low	104 Å²	104	145.7 Å²	145.7	73%	0.727	80%	0.801	S	S	*	*			cis	-149.6	-174.3	20.3	-50.7	0	0	0	0	107.4
362	E	37.4	Very low	40.9	Very low	165 Å²	165	146.4 Å²	146.4	77%	0.771	80%	0.804	S	S	*	*			cis	-168.6	139.7	31.3	-162.5	164.3	125.6	0	0	109.9
363	S	36.6	Very low	41.1	Very low	114 Å²	114	150.6 Å²	150.6	80%	0.797	80%	0.803	S	S	*	*			trans	-90.5	125.5	170.3	44.6	0	0	0	0	110.3
364	T	45.2	Very low	41.2	Very low	98 Å²	98	156.2 Å²	156.2	60%	0.601	81%	0.809	S	S	*	*			trans	-128.8	81.4	164.8	43.9	0	0	0	0	111.8	K366	T364-K366 PolarHBondContact O-N 3.14Å
365	D	38.2	Very low	41.5	Very low	163 Å²	163	153.5 Å²	153.5	87%	0.872	80%	0.804	S	S	*	*			trans	-57.6	115.5	158.9	-141.3	-25.3	0	0	0	108.7
366	K	52.9	Low	41.7	Very low	182 Å²	182	152.6 Å²	152.6	79%	0.791	80%	0.799	S	S	*	*			trans	-133.1	98	176.8	-83	-170.5	178.5	169.2	0	112.7	T364	T364-K366 PolarHBondContact O-N 3.14Å
367	S	39.3	Very low	41.7	Very low	114 Å²	114	146.5 Å²	146.5	80%	0.797	79%	0.792	S	S	*	*			trans	-44.7	130.9	167.8	-44.9	0	0	0	0	113.8
368	K	48.2	Very low	41.7	Very low	209 Å²	209	147 Å²	147	91%	0.909	80%	0.796	S	S	*	*			trans	-125.3	97.1	151.5	-102.1	-177.9	178.3	173.9	0	110.5	S370	K368-S370 PolarHBondContact O-N 3.18Å
369	A	39	Very low	42	Very low	99 Å²	99	147.3 Å²	147.3	82%	0.818	79%	0.793	S	S	*	*			trans	-68.5	109.1	172.6	0	0	0	0	0	110.7	R371	A369-R371 PolarHBondContact O-N 3.13Å
370	S	49.3	Very low	41.9	Very low	123 Å²	123	146.8 Å²	146.8	86%	0.86	80%	0.795	S	S	*	*			trans	-85.7	96.3	168.5	-167.9	0	0	0	0	110.4	K368 R372	K368-S370 PolarHBondContact O-N 3.18Å; S370-R372 PolarHBondContact O-N 2.78Å
371	R	42.7	Very low	42.4	Very low	230 Å²	230	147.5 Å²	147.5	87%	0.868	80%	0.8	S	S	*	*			trans	-87.8	88.1	-173.9	-173.1	-174.6	-171.2	-172.5	5.2	110.5	A369	A369-R371 PolarHBondContact O-N 3.13Å
372	R	47.1	Very low	42.3	Very low	245 Å²	245	146.7 Å²	146.7	93%	0.925	80%	0.799	S	S	*	*			trans	-116.8	134.5	163.3	-97.9	-176.1	169.2	-177.7	-3.2	112.2	S370	S370-R372 PolarHBondContact O-N 2.78Å
373	K	46.5	Very low	42.4	Very low	191 Å²	191	144.5 Å²	144.5	83%	0.83	80%	0.803	S	S	*	*			trans	-80.4	136.7	-156.3	-65.3	179.4	176.2	179.6	0	112.2
374	R	38.7	Very low	42.6	Very low	220 Å²	220	144.6 Å²	144.6	83%	0.83	80%	0.803	S	S	*	*			trans	-59.1	134.1	148.6	-85.1	175.1	161.3	149	-3.4	109
375	S	45.4	Very low	42.4	Very low	108 Å²	108	145.3 Å²	145.3	76%	0.755	81%	0.812	S	S	*	*			trans	-135.8	81.4	157.8	52.6	0	0	0	0	108.6	S377	S375-S377 PolarHBondContact O-N 3.3Å
376	H	39.1	Very low	42.7	Very low	157 Å²	157	145.7 Å²	145.7	73%	0.727	81%	0.813	S	S	*	*			trans	-71.4	122.1	159.9	-63.7	-84.9	0	0	0	107.3
377	S	41.8	Very low	42.2	Very low	104 Å²	104	145.8 Å²	145.8	73%	0.727	82%	0.817	S	S	*	*			trans	-128.4	74.9	167.4	46	0	0	0	0	108.7	S375 T379	S375-S377 PolarHBondContact O-N 3.3Å; S377-T379 PolarHBondContact O-N 3.29Å
378	S	38	Very low	42.3	Very low	114 Å²	114	145.1 Å²	145.1	80%	0.797	81%	0.812	S	S	*	*			trans	-73.5	109.1	159.7	49.7	0	0	0	0	108.2
379	T	40.7	Very low	42	Very low	125 Å²	125	146.4 Å²	146.4	77%	0.767	81%	0.811	S	S	*	*			trans	-134	101.3	169.6	-6.6	0	0	0	0	109.9	S377	S377-T379 PolarHBondContact O-N 3.29Å
380	S	38.1	Very low	42.2	Very low	119 Å²	119	146 Å²	146	83%	0.832	80%	0.803	S	S	*	*			trans	-79.4	115.9	172.3	49.9	0	0	0	0	111.3
381	S	44.9	Very low	41.8	Very low	113 Å²	113	145.8 Å²	145.8	79%	0.79	80%	0.801	S	S	*	*			trans	171	150.9	156.9	46.5	0	0	0	0	107.8
382	A	39.5	Very low	41.8	Very low	87 Å²	87	140 Å²	140	72%	0.719	80%	0.802	S	S	*	*			cis	-165.1	142.9	-18.5	0	0	0	0	0	104.7
383	S	38.2	Very low	41.7	Very low	120 Å²	120	133.9 Å²	133.9	84%	0.839	80%	0.797	S	S	*	*			trans	-42.2	133.5	169.7	48.3	0	0	0	0	114.8
384	S	42	Very low	41.7	Very low	116 Å²	116	134.7 Å²	134.7	81%	0.811	80%	0.804	S	S	*	*			trans	-156.4	123.9	135.5	49.6	0	0	0	0	111.9
385	S	41.1	Very low	41.9	Very low	113 Å²	113	127.4 Å²	127.4	79%	0.79	80%	0.797	S	S	*	*			trans	-92.3	128.2	168.2	51.6	0	0	0	0	109.4
386	L	44.2	Very low	42.1	Very low	171 Å²	171	131.9 Å²	131.9	90%	0.895	80%	0.803	S	S	*	*			trans	-136.6	110.6	161.2	-77.6	179.6	0	0	0	111.3
387	Q	42.3	Very low	42.5	Very low	184 Å²	184	133 Å²	133	86%	0.86	81%	0.808	S	S	*	*			trans	-74.9	141.8	154.2	-60.6	167	-58.3	0	0	108.3
388	S	42.2	Very low	42.8	Very low	100 Å²	100	133.9 Å²	133.9	70%	0.699	81%	0.809	S	S	*	*			trans	164.1	130.6	130.5	-82.5	0	0	0	0	113.2
389	R	41.6	Very low	43.9	Very low	235 Å²	235	140 Å²	140	89%	0.887	81%	0.814	S	S	*	*			trans	61	157	134.5	-65.6	173.4	157.9	-166.2	-8.5	118.8
390	S	41.7	Very low	44.1	Very low	92 Å²	92	141.6 Å²	141.6	64%	0.643	82%	0.818	S	S	*	*			cis	-172	137	-25.5	49.6	0	0	0	0	108.1
391	S	42	Very low	44.7	Very low	117 Å²	117	139.7 Å²	139.7	82%	0.818	82%	0.818	S	S	*	*			trans	28.8	119.1	150.8	57.2	0	0	0	0	121
392	A	43.5	Very low	44.7	Very low	110 Å²	110	139.6 Å²	139.6	91%	0.909	82%	0.817	S	S	*	*			trans	-147.8	152.8	146.9	0	0	0	0	0	110.1
393	S	45	Very low	44.9	Very low	116 Å²	116	140 Å²	140	81%	0.811	82%	0.815	S	S	*	*			trans	-137.3	123.5	-166.8	57.1	0	0	0	0	113.5
394	E	46.2	Very low	45.4	Very low	207 Å²	207	141.2 Å²	141.2	97%	0.967	82%	0.817	S	S	*	*			trans	-151.9	152.9	160.8	-70.5	-168.7	118.8	0	0	107.2
395	G	42.1	Very low	45.6	Very low	67 Å²	67	140.9 Å²	140.9	69%	0.691	82%	0.815	S	S	*	*			cis	164.2	137.2	-6.1	0	0	0	0	0	110.9
396	K	49.4	Very low	45.9	Very low	202 Å²	202	139.7 Å²	139.7	88%	0.878	81%	0.806	S	S	*	*			trans	65.2	114.3	164	-55.9	168.4	-177.9	167.7	0	119.2
397	H	47.7	Very low	46.1	Very low	181 Å²	181	142.6 Å²	142.6	84%	0.838	81%	0.805	S	S	*	*				-163.6	129.9	105.7	-117.5	-80.5	0	0	0	111.8
398	V	49.1	Very low	46.5	Very low	122 Å²	122	145.8 Å²	145.8	74%	0.739	81%	0.81	S	S	*	*			trans	-126.7	138.2	171.3	174.4	0	0	0	0	108
399	R	59.5	Low	46.6	Very low	242 Å²	242	146.4 Å²	146.4	91%	0.913	81%	0.814	S	S	*	*			trans	-138.7	110	166.6	-112.8	-174.3	175.8	-166.4	-0.7	108.9
400	N	46.5	Very low	47	Very low	159 Å²	159	146.9 Å²	146.9	85%	0.85	82%	0.816	S	S	*	*			trans	-87.9	142.2	167	-73	-12.9	0	0	0	109.2
401	G	49.2	Very low	47.2	Very low	80 Å²	80	146.9 Å²	146.9	83%	0.825	82%	0.821	S	S	*	*			trans	-145.5	138.9	171.3	0	0	0	0	0	108.4
402	S	46.1	Very low	47.7	Very low	110 Å²	110	145.6 Å²	145.6	77%	0.769	81%	0.812	S	S	*	*			trans	-127	148.2	-155.4	-165.5	0	0	0	0	114.1
403	S	42.4	Very low	47.9	Very low	97 Å²	97	147.2 Å²	147.2	68%	0.678	81%	0.806	S	S	*	*			trans	79.3	152.9	148.8	-56.7	0	0	0	0	121.3
404	T	48.8	Very low	48.2	Very low	144 Å²	144	151 Å²	151	88%	0.883	81%	0.808	S	S	*	*			trans	80.3	150	163.4	77	0	0	0	0	118
405	S	47.3	Very low	48.2	Very low	110 Å²	110	145.3 Å²	145.3	77%	0.769	80%	0.796	S	S	*	*			cis	-174.4	155.7	-29.9	-179.5	0	0	0	0	109.7
406	S	47.5	Very low	48.5	Very low	87 Å²	87	152.3 Å²	152.3	61%	0.608	81%	0.808	S	S	*	*			trans	76.5	114.1	146.6	172.3	0	0	0	0	122.4
407	R	48	Very low	48.3	Very low	232 Å²	232	147.6 Å²	147.6	88%	0.875	81%	0.806	S	S	*	*			trans	56.6	125.9	132.9	-59.6	170.8	160.9	168.2	-7	120.6
408	R	51.4	Low	48.4	Very low	251 Å²	251	145.7 Å²	145.7	95%	0.947	81%	0.807	S	S	*	*				-170	151.4	91.7	-105.7	-179	171.9	-166.3	-1.7	112.9
409	S	43.3	Very low	48.3	Very low	113 Å²	113	145.5 Å²	145.5	79%	0.79	81%	0.806	S	S	*	*			trans	-134.4	142.7	174.6	51.8	0	0	0	0	110.5
410	R	49.7	Very low	47.7	Very low	246 Å²	246	139.3 Å²	139.3	93%	0.928	80%	0.797	S	S	*	*			trans	168.8	121.8	156.8	-101.4	171.7	169.8	-174.3	-5.3	108.1
411	A	47.3	Very low	47.7	Very low	92 Å²	92	141.4 Å²	141.4	76%	0.76	80%	0.799	S	S	*	*				81.2	142.3	91.5	0	0	0	0	0	112.4
412	S	52.4	Low	47.4	Very low	90 Å²	90	147 Å²	147	63%	0.629	80%	0.8	S	S	*	*			cis	-167.1	173.3	-9.7	49	0	0	0	0	109.6
413	D	47.9	Very low	47.3	Very low	143 Å²	143	152.6 Å²	152.6	77%	0.765	81%	0.805	S	S	*	*			trans	65	141.6	159.3	-46.1	-53.3	0	0	0	117.5
414	K	49.9	Very low	47.2	Very low	196 Å²	196	153 Å²	153	85%	0.852	81%	0.814	S	S	*	*			cis	-174.3	164.9	27.3	-149.7	163	-178.8	169.6	0	110.3
415	A	46.4	Very low	47	Very low	88 Å²	88	153.3 Å²	153.3	73%	0.727	81%	0.809	S	S	*	*			trans	61.5	107.5	164.2	0	0	0	0	0	118.1
416	K	49	Very low	46.8	Very low	214 Å²	214	152.7 Å²	152.7	93%	0.93	81%	0.805	S	S	*	*				58.4	93	80.1	-77.1	-168.9	172.5	-176.9	0	115.2
417	A	45.9	Very low	46.7	Very low	102 Å²	102	154.5 Å²	154.5	84%	0.843	82%	0.815	S	S	*	*			trans	-146.8	154.3	149.6	0	0	0	0	0	110
418	T	48.4	Very low	46.3	Very low	141 Å²	141	151.8 Å²	151.8	87%	0.865	81%	0.812	S	S	*	*			trans	-93.4	151	-155.7	-39.9	0	0	0	0	114.3
419	V	48.5	Very low	45.9	Very low	119 Å²	119	147.1 Å²	147.1	72%	0.721	80%	0.804	S	S	*	*			trans	-65.2	142.8	174.6	179.9	0	0	0	0	110.8
420	P	45.3	Very low	45.9	Very low	111 Å²	111	146.4 Å²	146.4	72%	0.721	80%	0.797	S	S	*	*				-133.7	132.4	112.3	33.1	-22.2	0	0	0	113.4	K422	P420-K422 PolarHBondContact O-N 3.2Å
421	K	46.9	Very low	45.5	Very low	204 Å²	204	144.3 Å²	144.3	89%	0.887	80%	0.795	S	S	*	*			trans	-60.2	121.5	161.9	-76.3	171.6	172.9	171	0	108.9
422	K	42.7	Very low	45.2	Very low	196 Å²	196	147.1 Å²	147.1	85%	0.852	80%	0.796	S	S	*	*			trans	-119.7	108.8	152.3	-80.2	-172	173.9	-177.7	0	108.9	P420 A424	P420-K422 PolarHBondContact O-N 3.2Å; K422-A424 PolarHBondContact O-N 3.31Å
423	R	44.2	Very low	44.6	Very low	229 Å²	229	148.4 Å²	148.4	86%	0.864	80%	0.801	S	S	*	*			trans	-57.4	126.8	157.7	-93.6	175	162.1	160.6	-7.9	106.5	L425	R423-L425 VanDerWaalsContact C-N 3.29Å; R423-L425 PolarHBondContact O-N 2.89Å
424	A	40.3	Very low	44.2	Very low	106 Å²	106	151.1 Å²	151.1	88%	0.876	81%	0.809	S	S	*	*			trans	-66.9	98.6	156.5	0	0	0	0	0	106.6	K422	K422-A424 PolarHBondContact O-N 3.31Å
425	L	45.7	Very low	43.9	Very low	150 Å²	150	150.1 Å²	150.1	79%	0.785	81%	0.807	S	S	*	*			trans	-65.9	145	165.6	-85.5	146.6	0	0	0	108.2	R423	R423-L425 VanDerWaalsContact C-N 3.29Å; R423-L425 PolarHBondContact O-N 2.89Å
426	S	42.8	Very low	43.5	Very low	96 Å²	96	151.2 Å²	151.2	67%	0.671	81%	0.81	S	S	*	*			trans	-50.2	150.9	170.6	-55.6	0	0	0	0	110.9	H428	S426-H428 VanDerWaalsContact C-N 3.34Å; S426-H428 PolarHBondContact O-N 3.45Å
427	P	45.2	Very low	42.8	Very low	126 Å²	126	145.3 Å²	145.3	82%	0.818	80%	0.8	S	S	*	*			trans	-61.6	101.6	163.3	27.8	-32.4	0	0	0	107.8	L429	P427-L429 PolarHBondContact O-N 3.45Å; P427-L429 VanDerWaalsContact O-N 3.09Å
428	H	40	Very low	42.4	Very low	175 Å²	175	149.1 Å²	149.1	81%	0.81	80%	0.801	S	S	*	*			trans	-66.5	108.7	165	-112	-76.6	0	0	0	106.4	S426	S426-H428 VanDerWaalsContact C-N 3.34Å; S426-H428 PolarHBondContact O-N 3.45Å
429	L	41.4	Very low	41.9	Very low	152 Å²	152	148.4 Å²	148.4	80%	0.796	80%	0.796	S	S	*	*			trans	-51.4	137.4	169	-75.8	157.5	0	0	0	108.7	P427 K431	P427-L429 PolarHBondContact O-N 3.45Å; P427-L429 VanDerWaalsContact O-N 3.09Å; L429-K431 PolarHBondContact O-N 3.01Å
430	P	44.8	Very low	41	Very low	98 Å²	98	153.3 Å²	153.3	64%	0.636	80%	0.803	S	S	*	*			trans	-57.2	133.5	165.6	26.7	-32.5	0	0	0	107.7	L432	P430-L432 PolarHBondContact O-N 3.37Å
431	K	40.6	Very low	40.6	Very low	203 Å²	203	155 Å²	155	88%	0.883	80%	0.802	S	S	*	*			trans	-73	82	175.7	-163.8	179.6	-173.3	-172.9	0	107.1	L429 T433	L429-K431 PolarHBondContact O-N 3.01Å; K431-T433 PolarHBondContact O-N 3.47Å
432	L	40.3	Very low	40.1	Very low	150 Å²	150	149.8 Å²	149.8	79%	0.785	79%	0.788	S	S	*	*			trans	-63.6	101.9	173.8	-80.1	164.9	0	0	0	107.8	P430	P430-L432 PolarHBondContact O-N 3.37Å
433	T	41.2	Very low	39.6	Very low	118 Å²	118	145.3 Å²	145.3	72%	0.724	78%	0.777	S	S	*	*			trans	-58.9	146.2	158.8	37	0	0	0	0	109.2	K431 E435	K431-T433 PolarHBondContact O-N 3.47Å; T433-E435 PolarHBondContact O-N 2.93Å
434	E	39	Very low	39	Very low	200 Å²	200	143 Å²	143	94%	0.935	77%	0.774	S	S	*	*	S	Bend	trans	-67.1	92.9	-173.9	-64.1	170.5	135.4	0	0	111.5
435	E	43	Very low	38.7	Very low	174 Å²	174	143 Å²	143	81%	0.813	76%	0.763	S	S	*	*	S	Bend	trans	-147.5	108.2	165.4	-109.7	167.8	-166.6	0	0	109.2	T433 A437	T433-E435 PolarHBondContact O-N 2.93Å; E435-A437 PolarHBondContact O-N 3.46Å
436	S	37.4	Very low	38.1	Very low	112 Å²	112	143.7 Å²	143.7	78%	0.783	77%	0.766	S	S	*	*			trans	26.1	78.2	160.4	55.3	0	0	0	0	117.8	E438	S436-E438 PolarHBondContact O-N 3.03Å; S436-E438 VanDerWaalsContact O-N 3.07Å
437	A	36	Very low	37.6	Very low	89 Å²	89	143.5 Å²	143.5	74%	0.736	76%	0.761	S	S	*	*			trans	-78.6	84.7	164.8	0	0	0	0	0	110.4	E435 V439	E435-A437 PolarHBondContact O-N 3.46Å; A437-V439 PolarHBondContact O-N 2.86Å; A437-V439 VanDerWaalsContact O-N 3.1Å
438	E	37.6	Very low	37.4	Very low	182 Å²	182	144.1 Å²	144.1	85%	0.85	76%	0.763	S	S	*	*			trans	-57.9	113.3	170.8	-74	-174.1	138.3	0	0	110.3	S436 Y440	S436-E438 PolarHBondContact O-N 3.03Å; S436-E438 VanDerWaalsContact O-N 3.07Å; E438-Y440 PolarHBondContact O-N 3.16Å
439	V	36.8	Very low	37.1	Very low	127 Å²	127	143.8 Å²	143.8	77%	0.77	76%	0.762	S	S	*	*			trans	-75.8	95.6	176.3	178.4	0	0	0	0	108.4	A437 Q441	A437-V439 PolarHBondContact O-N 2.86Å; A437-V439 VanDerWaalsContact O-N 3.1Å; V439-Q441 VanDerWaalsContact C-N 3.32Å; V439-Q441 HydrophobicContact CG1-CG 4.47Å; V439-Q441 PolarHBondContact O-N 2.85Å
440	Y	29.1	Very low	36.7	Very low	222 Å²	222	141.4 Å²	141.4	87%	0.871	75%	0.753	S	S	*	*			trans	-62.7	86.5	176.9	-153	-87.4	0	0	0	111	E438	E438-Y440 PolarHBondContact O-N 3.16Å
441	Q	37.8	Very low	36.1	Very low	147 Å²	147	146.3 Å²	146.3	69%	0.687	77%	0.768	S	S	*	*			trans	-76	126.4	168.8	-71.1	-162.6	16	0	0	109.1	V439 V443	V439-Q441 VanDerWaalsContact C-N 3.32Å; V439-Q441 HydrophobicContact CG1-CG 4.47Å; V439-Q441 PolarHBondContact O-N 2.85Å; Q441-V443 VanDerWaalsContact C-N 3.34Å; Q441-V443 PolarHBondContact O-N 3.18Å
442	P	35.7	Very low	36	Very low	94 Å²	94	143.1 Å²	143.1	61%	0.61	76%	0.76	S	S	*	*			trans	-72.5	91	170.6	29.9	-33.3	0	0	0	109.7	F444	P442-F444 HydrophobicContact CB-CD2 4.42Å; P442-F444 HydrophobicContact CB-CE2 3.85Å; P442-F444 HydrophobicContact CB-CZ 4.36Å; P442-F444 HydrophobicContact CG-CE2 4.33Å; P442-F444 WeakPolarHBondContact O-CD2 3.45Å; P442-F444 PolarHBondContact O-N 3.27Å
443	V	32.5	Very low	36.1	Very low	102 Å²	102	141.4 Å²	141.4	62%	0.618	76%	0.758	S	S	*	*			trans	-74.4	100.8	171.2	-176.2	0	0	0	0	108.5	Q441 V445	Q441-V443 VanDerWaalsContact C-N 3.34Å; Q441-V443 PolarHBondContact O-N 3.18Å; V443-V445 HydrophobicContact CG1-CG2 3.8Å; V443-V445 PolarHBondContact O-N 3.2Å; V443-V445 VanDerWaalsContact O-N 3.13Å
444	F	32	Very low	35.9	Very low	180 Å²	180	147.4 Å²	147.4	79%	0.789	77%	0.767	S	S	*	*			trans	-80.5	87.8	170.1	-68.9	-81.5	0	0	0	109.5	P442 L446	P442-F444 HydrophobicContact CB-CD2 4.42Å; P442-F444 HydrophobicContact CB-CE2 3.85Å; P442-F444 HydrophobicContact CB-CZ 4.36Å; P442-F444 HydrophobicContact CG-CE2 4.33Å; P442-F444 WeakPolarHBondContact O-CD2 3.45Å; P442-F444 PolarHBondContact O-N 3.27Å; F444-L446 PolarHBondContact O-N 3.49Å; F444-L446 VanDerWaalsContact O-N 3.14Å
445	V	34	Very low	36	Very low	106 Å²	106	143.7 Å²	143.7	64%	0.642	76%	0.761	S	S	*	*			trans	-68.8	107.5	171.2	-169.5	0	0	0	0	108.6	V443 T447	V443-V445 HydrophobicContact CG1-CG2 3.8Å; V443-V445 PolarHBondContact O-N 3.2Å; V443-V445 VanDerWaalsContact O-N 3.13Å; V445-T447 VanDerWaalsContact C-N 3.28Å; V445-T447 HydrophobicContact CG1-CG2 3.65Å; V445-T447 PolarHBondContact O-N 3.28Å; V445-T447 VanDerWaalsContact O-N 3.12Å
446	L	32.2	Very low	35.7	Very low	165 Å²	165	140.4 Å²	140.4	86%	0.864	76%	0.757	S	S	*	*			trans	-78.8	82.7	163	-79.6	167.1	0	0	0	108	F444 T448	F444-L446 PolarHBondContact O-N 3.49Å; F444-L446 VanDerWaalsContact O-N 3.14Å; L446-T448 PolarHBondContact O-N 3.29Å; L446-T448 VanDerWaalsContact O-N 3.1Å
447	T	33.1	Very low	35.8	Very low	92 Å²	92	139.6 Å²	139.6	56%	0.564	75%	0.751	S	S	*	*			trans	-64.3	109.2	169.7	46	0	0	0	0	108.9	V445 E449	V445-T447 VanDerWaalsContact C-N 3.28Å; V445-T447 HydrophobicContact CG1-CG2 3.65Å; V445-T447 PolarHBondContact O-N 3.28Å; V445-T447 VanDerWaalsContact O-N 3.12Å; T447-E449 PolarHBondContact O-N 3.41Å
448	T	41.7	Very low	35.8	Very low	138 Å²	138	147.5 Å²	147.5	85%	0.847	76%	0.762	S	S	*	*			trans	-72.8	-2.8	168.6	47	0	0	0	0	112.3	L446 T450	L446-T448 PolarHBondContact O-N 3.29Å; L446-T448 VanDerWaalsContact O-N 3.1Å; T448-T450 VanDerWaalsContact C-N 3.26Å; T448-T450 PolarHBondContact O-N 3.15Å
449	E	32.1	Very low	36.2	Very low	169 Å²	169	145.1 Å²	145.1	79%	0.79	76%	0.759	S	S	*	*			trans	-79.1	71.5	173.3	-63.4	-176.9	174.5	0	0	111	T447	T447-E449 PolarHBondContact O-N 3.41Å
450	T	34.4	Very low	36.5	Very low	102 Å²	102	148.3 Å²	148.3	63%	0.626	76%	0.763	S	S	*	*			trans	-112.3	102.2	146.5	47	0	0	0	0	107.1	T448 L452	T448-T450 VanDerWaalsContact C-N 3.26Å; T448-T450 PolarHBondContact O-N 3.15Å; T450-L452 PolarHBondContact O-N 3.06Å
451	E	32.5	Very low	37.1	Very low	201 Å²	201	148.1 Å²	148.1	94%	0.939	77%	0.766	S	S	*	*			trans	-65.7	77.7	167.1	-69.6	-164.8	143.9	0	0	109.1
452	L	37.3	Very low	37.5	Very low	135 Å²	135	146.8 Å²	146.8	71%	0.707	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-71.1	132.8	169.9	-75.2	167.4	0	0	0	108.2	T450 W454	T450-L452 PolarHBondContact O-N 3.06Å; L452-W454 PolarHBondContact O-N 3.28Å
453	P	42.2	Very low	37.9	Very low	115 Å²	115	152.4 Å²	152.4	75%	0.747	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-63.2	123.4	-171.1	24.7	-34.1	0	0	0	110.3
454	W	37.3	Very low	38.4	Very low	243 Å²	243	153 Å²	153	92%	0.92	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-52.5	127.7	168.1	-75.1	86.6	0	0	0	108.8	L452 S456	L452-W454 PolarHBondContact O-N 3.28Å; W454-S456 VanDerWaalsContact C-N 3.27Å; W454-S456 PolarHBondContact O-N 3.47Å
455	P	41.5	Very low	38.8	Very low	123 Å²	123	149.1 Å²	149.1	80%	0.799	79%	0.786	S	S	*	*			trans	-69.7	88.1	178.7	27.4	-33.5	0	0	0	109.5
456	S	35.8	Very low	39.5	Very low	105 Å²	105	149.2 Å²	149.2	73%	0.734	79%	0.789	S	S	*	*			trans	-64.6	145.9	167	74.4	0	0	0	0	109.2	W454	W454-S456 VanDerWaalsContact C-N 3.27Å; W454-S456 PolarHBondContact O-N 3.47Å
457	S	40.2	Very low	40.5	Very low	94 Å²	94	145.3 Å²	145.3	66%	0.657	78%	0.775	S	S	*	*	S	Bend	trans	71.3	106.8	-178.5	79.8	0	0	0	0	117.7	V459	S457-V459 PolarHBondContact O-N 3.26Å
458	R	36.6	Very low	41.2	Very low	255 Å²	255	146.7 Å²	146.7	96%	0.962	78%	0.778	S	S	*	*			trans	38.1	68.3	133.9	-60.5	-178.8	173.5	-169.4	-2.1	118
459	V	44.8	Very low	41.5	Very low	132 Å²	132	145.5 Å²	145.5	80%	0.8	77%	0.771	S	S	*	*			trans	-105.2	125.7	159.1	-174.9	0	0	0	0	109.9	S457	S457-V459 PolarHBondContact O-N 3.26Å
460	K	44.2	Very low	42.3	Very low	194 Å²	194	145.4 Å²	145.4	84%	0.843	76%	0.764	S	S	*	*			trans	-64.7	142.6	178.1	-74.5	177.4	174.9	176.8	0	110.2	T462	K460-T462 PolarHBondContact O-N 3.21Å
461	K	40.9	Very low	43.7	Very low	218 Å²	218	143.5 Å²	143.5	95%	0.948	76%	0.755	S	S	*	*			trans	-56.4	106	176.3	-65.5	180	179.2	179.9	0	111.2
462	T	46.6	Very low	44.8	Very low	119 Å²	119	142.1 Å²	142.1	73%	0.73	74%	0.742	S	S	*	*			trans	-113.4	126.8	161.5	45.6	0	0	0	0	109	K460 C464	K460-T462 PolarHBondContact O-N 3.21Å; T462-C464 PolarHBondContact O-N 3.47Å; T462-C464 VanDerWaalsContact O-N 3.1Å
463	K	44.3	Very low	46.2	Very low	213 Å²	213	140.3 Å²	140.3	93%	0.926	74%	0.737	S	S	*	*			trans	-76	93.8	-176.3	-68.5	-179.1	176.5	-177.8	0	110.8
464	C	43.7	Very low	47.6	Very low	113 Å²	113	140.4 Å²	140.4	76%	0.764	73%	0.731	S	S	*	*			trans	-135.2	114.9	163.2	-70.5	0	0	0	0	109.6	T462 P466	T462-C464 PolarHBondContact O-N 3.47Å; T462-C464 VanDerWaalsContact O-N 3.1Å; C464-P466 WeakPolarHBondContact O-CD 3.2Å
465	S	40	Very low	49.2	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	72%	0.718	S	S	*	*			trans	-82.4	121.2	-171.1	-52.7	0	0	0	0	112.3	S467	S465-S467 PolarHBondContact O-N 2.87Å
466	P	49.3	Very low	51.1	Low	108 Å²	108	133.2 Å²	133.2	70%	0.701	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	4.1	177	-17.7	33	0	0	0	115.3	C464	C464-P466 WeakPolarHBondContact O-CD 3.2Å
467	S	51.6	Low	53	Low	83 Å²	83	131.2 Å²	131.2	58%	0.58	69%	0.69	S	S	*	*	H	α-helix	trans	-82.2	-21.4	-157.5	50.9	0	0	0	0	116.4	S465	S465-S467 PolarHBondContact O-N 2.87Å
468	I	47.7	Very low	54.7	Low	121 Å²	121	132.3 Å²	132.3	62%	0.621	68%	0.683	S	S	*	*	H	α-helix	trans	-78.1	-45.5	-166.6	-64.8	177	0	0	0	112.3	Y470 S471	I468-Y470 PolarHBondContact O-N 2.84Å; I468-S471 PolarHBondContact O-N 3.24Å; I468-S471 PolarHBondContact O-OG 2.71Å
469	T	49.3	Very low	56.9	Low	114 Å²	114	127.1 Å²	127.1	70%	0.699	67%	0.668	S	S	*	*	H	α-helix	trans	-68.5	-34.5	-171.5	-34	0	0	0	0	113.4	S471	T469-S471 PolarHBondContact O-N 2.86Å
470	Y	48.6	Very low	58.6	Low	167 Å²	167	127.1 Å²	127.1	66%	0.655	66%	0.659	S	S	*	*	H	α-helix	trans	-63.9	-26.2	178.2	-78.6	-86.5	0	0	0	113.4	I468 Y472 T473 L474	I468-Y470 PolarHBondContact O-N 2.84Å; Y470-Y472 PolarHBondContact O-N 3.22Å; Y470-T473 PolarHBondContact O-OG1 3.11Å; Y470-L474 WeakPolarHBondContact O-CB 3.26Å; Y470-L474 WeakPolarHBondContact O-CD1 3.39Å; Y470-L474 WeakPolarHBondContact O-CG 3.46Å; Y470-L474 PolarHBondContact O-N 3.21Å
471	S	62.6	Low	60.4	Low	62 Å²	62	123 Å²	123	43%	0.434	65%	0.645	S	S	.	*	H	α-helix	trans	-67.4	-36.9	-176.1	70.8	0	0	0	0	113.4	I468 T469 R475	I468-S471 PolarHBondContact O-N 3.24Å; I468-S471 PolarHBondContact O-OG 2.71Å; T469-S471 PolarHBondContact O-N 2.86Å; S471-R475 VanDerWaalsContact O-CB 3.26Å; S471-R475 WeakPolarHBondContact O-CB 3.45Å; S471-R475 PolarHBondContact O-N 2.81Å; S471-R475 VanDerWaalsContact O-N 3.12Å
472	Y	56	Low	62.5	Low	171 Å²	171	117.1 Å²	117.1	67%	0.671	62%	0.624	S	S	*	*	H	α-helix	trans	-76	-41.7	-175.2	-83.4	-86.6	0	0	0	113	Y470 R475 G476	Y470-Y472 PolarHBondContact O-N 3.22Å; Y472-R475 PolarHBondContact O-N 3.42Å; Y472-G476 PolarHBondContact O-N 3.22Å
473	T	66.9	Low	64.3	Low	97 Å²	97	114.2 Å²	114.2	60%	0.595	61%	0.612	S	S	*	*	H	α-helix	trans	-67.5	-44	178.7	52.2	0	0	0	0	111.3	Y470 R475 G476 A477	Y470-T473 PolarHBondContact O-OG1 3.11Å; T473-R475 VanDerWaalsContact C-N 3.34Å; T473-R475 PolarHBondContact O-N 2.86Å; T473-G476 PolarHBondContact O-N 3.04Å; T473-A477 PolarHBondContact O-N 3.23Å
474	L	71.8	Confident	66.2	Low	117 Å²	117	107 Å²	107	61%	0.613	59%	0.586	S	S	*	*	H	α-helix	trans	-59.7	-42.2	173.2	-75.2	170.1	0	0	0	112	Y470 G476 A477 F478	Y470-L474 WeakPolarHBondContact O-CB 3.26Å; Y470-L474 WeakPolarHBondContact O-CD1 3.39Å; Y470-L474 WeakPolarHBondContact O-CG 3.46Å; Y470-L474 PolarHBondContact O-N 3.21Å; L474-G476 VanDerWaalsContact C-N 3.32Å; L474-G476 PolarHBondContact O-N 3.5Å; L474-A477 PolarHBondContact O-N 3.3Å; L474-F478 WeakPolarHBondContact O-CB 3.07Å; L474-F478 PolarHBondContact O-N 3.12Å
475	R	71.3	Confident	68.1	Low	174 Å²	174	106.2 Å²	106.2	66%	0.657	57%	0.571	S	S	*	*	H	α-helix	trans	-66.3	-33.3	177.4	-163.7	174.7	-168.6	-173.9	3.8	112.6	S471 Y472 T473 K479	S471-R475 VanDerWaalsContact O-CB 3.26Å; S471-R475 WeakPolarHBondContact O-CB 3.45Å; S471-R475 PolarHBondContact O-N 2.81Å; S471-R475 VanDerWaalsContact O-N 3.12Å; Y472-R475 PolarHBondContact O-N 3.42Å; T473-R475 VanDerWaalsContact C-N 3.34Å; T473-R475 PolarHBondContact O-N 2.86Å; R475-K479 WeakPolarHBondContact O-CG 3.28Å; R475-K479 PolarHBondContact O-N 3.45Å
476	G	80.5	Confident	70.2	Confident	41 Å²	41	109.3 Å²	109.3	42%	0.423	57%	0.567	S	S	.	*	H	α-helix	trans	-67	-51.5	171.8	0	0	0	0	0	112.5	Y472 T473 L474 F478 K479 H480	Y472-G476 PolarHBondContact O-N 3.22Å; T473-G476 PolarHBondContact O-N 3.04Å; L474-G476 VanDerWaalsContact C-N 3.32Å; L474-G476 PolarHBondContact O-N 3.5Å; G476-F478 VanDerWaalsContact C-N 3.33Å; G476-F478 PolarHBondContact O-N 2.96Å; G476-K479 PolarHBondContact O-N 3.47Å; G476-H480 PolarHBondContact O-N 3.14Å; G476-H480 VanDerWaalsContact O-N 3.07Å
477	A	76.8	Confident	72.2	Confident	63 Å²	63	111.2 Å²	111.2	52%	0.521	56%	0.564	S	S	.	*	H	α-helix	trans	-58.3	-43.6	177.7	0	0	0	0	0	112	T473 L474 K479 H480 L481	T473-A477 PolarHBondContact O-N 3.23Å; L474-A477 PolarHBondContact O-N 3.3Å; A477-K479 PolarHBondContact O-N 3.1Å; A477-H480 PolarHBondContact O-N 3.38Å; A477-H480 VanDerWaalsContact O-N 3.15Å; A477-L481 WeakPolarHBondContact O-CB 3.33Å; A477-L481 PolarHBondContact O-N 3.33Å
478	F	75.7	Confident	73.9	Confident	118 Å²	118	111 Å²	111	52%	0.518	56%	0.559	S	S	.	*	H	α-helix	trans	-64.1	-39	178.2	-169	-105.1	0	0	0	112.9	L474 G476 H480 L481 L482	L474-F478 WeakPolarHBondContact O-CB 3.07Å; L474-F478 PolarHBondContact O-N 3.12Å; G476-F478 VanDerWaalsContact C-N 3.33Å; G476-F478 PolarHBondContact O-N 2.96Å; F478-H480 VanDerWaalsContact C-N 3.34Å; F478-L481 PolarHBondContact O-N 2.75Å; F478-L482 HydrophobicContact CD1-CD1 3.86Å; F478-L482 HydrophobicContact CD1-CG 4.39Å; F478-L482 HydrophobicContact CE1-CD1 3.56Å; F478-L482 HydrophobicContact CE1-CG 4.14Å; F478-L482 HydrophobicContact CZ-CD1 4.25Å; F478-L482 HydrophobicContact CZ-CG 4.42Å; F478-L482 WeakPolarHBondContact O-CG 3.49Å; F478-L482 PolarHBondContact O-N 3.47Å
479	K	82.2	Confident	75.7	Confident	145 Å²	145	110.6 Å²	110.6	63%	0.63	55%	0.55	S	S	*	.	H	α-helix	trans	-61.6	-42.3	171.8	-78.8	-178.8	176.6	-175.6	0	111.7	R475 G476 A477 L482 A483	R475-K479 WeakPolarHBondContact O-CG 3.28Å; R475-K479 PolarHBondContact O-N 3.45Å; G476-K479 PolarHBondContact O-N 3.47Å; A477-K479 PolarHBondContact O-N 3.1Å; K479-L482 PolarHBondContact O-N 3.09Å; K479-A483 PolarHBondContact O-N 3.35Å; K479-A483 VanDerWaalsContact O-N 3.08Å
480	H	80	Confident	77.5	Confident	133 Å²	133	110.2 Å²	110.2	62%	0.616	54%	0.54	S	S	*	.	H	α-helix	trans	-67.5	-39.1	179.4	-158.5	-33.3	0	0	0	112	G476 A477 F478 A483 T484	G476-H480 PolarHBondContact O-N 3.14Å; G476-H480 VanDerWaalsContact O-N 3.07Å; A477-H480 PolarHBondContact O-N 3.38Å; A477-H480 VanDerWaalsContact O-N 3.15Å; F478-H480 VanDerWaalsContact C-N 3.34Å; H480-A483 PolarHBondContact O-N 2.98Å; H480-T484 PolarHBondContact O-N 3.37Å; H480-T484 PolarHBondContact O-OG1 3.17Å
481	L	82.9	Confident	79.4	Confident	106 Å²	106	106.3 Å²	106.3	56%	0.555	53%	0.528	S	S	*	.	H	α-helix	trans	-63.4	-41.1	174.9	-176.5	66.4	0	0	0	112.4	A477 F478 A483 T484 H485	A477-L481 WeakPolarHBondContact O-CB 3.33Å; A477-L481 PolarHBondContact O-N 3.33Å; F478-L481 PolarHBondContact O-N 2.75Å; L481-A483 VanDerWaalsContact C-N 3.34Å; L481-T484 PolarHBondContact O-OG1 3.21Å; L481-H485 VanDerWaalsContact O-CB 3.26Å; L481-H485 WeakPolarHBondContact O-CB 3.48Å; L481-H485 PolarHBondContact O-N 3.23Å
482	L	84.6	Confident	80.6	Confident	95 Å²	95	107.2 Å²	107.2	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-64.6	-38.3	174.2	-74	174.3	0	0	0	112.1	F478 K479 R486	F478-L482 HydrophobicContact CD1-CD1 3.86Å; F478-L482 HydrophobicContact CD1-CG 4.39Å; F478-L482 HydrophobicContact CE1-CD1 3.56Å; F478-L482 HydrophobicContact CE1-CG 4.14Å; F478-L482 HydrophobicContact CZ-CD1 4.25Å; F478-L482 HydrophobicContact CZ-CG 4.42Å; F478-L482 WeakPolarHBondContact O-CG 3.49Å; F478-L482 PolarHBondContact O-N 3.47Å; K479-L482 PolarHBondContact O-N 3.09Å; L482-R486 WeakPolarHBondContact O-CB 3.46Å; L482-R486 PolarHBondContact O-N 3.28Å
483	A	84.5	Confident	82.1	Confident	59 Å²	59	107 Å²	107	49%	0.488	53%	0.527	S	S	.	.	H	α-helix	trans	-67.8	-43	177.7	0	0	0	0	0	112.5	K479 H480 L481 R486 K487	K479-A483 PolarHBondContact O-N 3.35Å; K479-A483 VanDerWaalsContact O-N 3.08Å; H480-A483 PolarHBondContact O-N 2.98Å; L481-A483 VanDerWaalsContact C-N 3.34Å; A483-R486 PolarHBondContact O-N 3.47Å; A483-K487 PolarHBondContact O-N 3.06Å
484	T	84.6	Confident	83.1	Confident	60 Å²	60	105.1 Å²	105.1	37%	0.368	52%	0.522	S	S	.	.	H	α-helix	trans	-67.2	-45.2	176.5	51.6	0	0	0	0	111.6	H480 L481 R486 K487 V488	H480-T484 PolarHBondContact O-N 3.37Å; H480-T484 PolarHBondContact O-OG1 3.17Å; L481-T484 PolarHBondContact O-OG1 3.21Å; T484-R486 VanDerWaalsContact C-N 3.29Å; T484-R486 PolarHBondContact O-N 3.17Å; T484-K487 WeakPolarHBondContact O-CB 3.44Å; T484-K487 PolarHBondContact O-N 3.05Å; T484-K487 VanDerWaalsContact O-N 3.11Å; T484-V488 WeakPolarHBondContact O-CG2 3.44Å; T484-V488 PolarHBondContact O-N 3.06Å
485	H	82.8	Confident	84	Confident	98 Å²	98	106.2 Å²	106.2	45%	0.454	52%	0.518	S	S	.	.	H	α-helix	trans	-60.9	-36.7	176.6	-178.2	-105.7	0	0	0	112.5	L481 R489	L481-H485 VanDerWaalsContact O-CB 3.26Å; L481-H485 WeakPolarHBondContact O-CB 3.48Å; L481-H485 PolarHBondContact O-N 3.23Å; H485-R489 PolarHBondContact CE1-NH2 3.01Å; H485-R489 WeakPolarHBondContact O-CB 3.33Å; H485-R489 PolarHBondContact O-N 2.81Å; H485-R489 VanDerWaalsContact O-N 3.12Å
486	R	85.6	Confident	84.8	Confident	164 Å²	164	102.2 Å²	102.2	62%	0.619	50%	0.503	S	S	*	.	H	α-helix	trans	-63.6	-47	171.8	-179.1	175.5	176.5	165	1.6	111.9	L482 A483 T484 V488 R489 E490	L482-R486 WeakPolarHBondContact O-CB 3.46Å; L482-R486 PolarHBondContact O-N 3.28Å; A483-R486 PolarHBondContact O-N 3.47Å; T484-R486 VanDerWaalsContact C-N 3.29Å; T484-R486 PolarHBondContact O-N 3.17Å; R486-V488 PolarHBondContact O-N 3.39Å; R486-R489 PolarHBondContact O-N 3.19Å; R486-E490 WeakPolarHBondContact CG-OE1 3.18Å; R486-E490 IonicContact CZ-OE1 3.9Å; R486-E490 IonicContact NE-OE1 3.88Å; R486-E490 PolarHBondContact NE-OE1 3.47Å; R486-E490 IonicContact NH2-OE1 3.05Å; R486-E490 PolarHBondContact NH2-OE1 3.25Å; R486-E490 WeakPolarHBondContact O-CG 3.1Å; R486-E490 PolarHBondContact O-N 3.4Å
487	K	89.4	Confident	85.1	Confident	147 Å²	147	107.9 Å²	107.9	64%	0.639	51%	0.511	S	S	*	.	H	α-helix	trans	-59.9	-46.2	178.6	-172.9	-176.8	176.6	-172	0	112	A483 T484 R489 E490 E491	A483-K487 PolarHBondContact O-N 3.06Å; T484-K487 WeakPolarHBondContact O-CB 3.44Å; T484-K487 PolarHBondContact O-N 3.05Å; T484-K487 VanDerWaalsContact O-N 3.11Å; K487-R489 VanDerWaalsContact C-N 3.32Å; K487-R489 PolarHBondContact O-N 3.1Å; K487-E490 PolarHBondContact O-N 3.04Å; K487-E491 PolarHBondContact O-N 2.86Å
488	V	87.9	Confident	85.8	Confident	78 Å²	78	111.5 Å²	111.5	47%	0.473	52%	0.516	S	S	.	.	H	α-helix	trans	-61	-40.1	177.1	172.1	0	0	0	0	111.5	T484 R486 E491 N492	T484-V488 WeakPolarHBondContact O-CG2 3.44Å; T484-V488 PolarHBondContact O-N 3.06Å; R486-V488 PolarHBondContact O-N 3.39Å; V488-E491 PolarHBondContact O-N 3.24Å; V488-N492 WeakPolarHBondContact O-CB 2.91Å; V488-N492 PolarHBondContact O-N 2.93Å
489	R	85.1	Confident	86.5	Confident	113 Å²	113	111.1 Å²	111.1	43%	0.426	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-43	176.1	-177.4	-176.3	-67	-166.5	-11.7	112.7	V212 H485 R486 K487 E491 Y493	V212-R489 PolarHBondContact O-NH1 3.23Å; H485-R489 PolarHBondContact CE1-NH2 3.01Å; H485-R489 WeakPolarHBondContact O-CB 3.33Å; H485-R489 PolarHBondContact O-N 2.81Å; H485-R489 VanDerWaalsContact O-N 3.12Å; R486-R489 PolarHBondContact O-N 3.19Å; K487-R489 VanDerWaalsContact C-N 3.32Å; K487-R489 PolarHBondContact O-N 3.1Å; R489-E491 VanDerWaalsContact C-N 3.34Å; R489-Y493 WeakPolarHBondContact O-CB 3.41Å; R489-Y493 PolarHBondContact O-N 3.18Å
490	E	87.8	Confident	86.9	Confident	106 Å²	106	109.1 Å²	109.1	50%	0.495	51%	0.511	S	S	.	.	H	α-helix	trans	-64.8	-38.9	177.8	-72.5	171.7	-176.3	0	0	110.9	R486 K487 A494	R486-E490 WeakPolarHBondContact CG-OE1 3.18Å; R486-E490 IonicContact CZ-OE1 3.9Å; R486-E490 IonicContact NE-OE1 3.88Å; R486-E490 PolarHBondContact NE-OE1 3.47Å; R486-E490 IonicContact NH2-OE1 3.05Å; R486-E490 PolarHBondContact NH2-OE1 3.25Å; R486-E490 WeakPolarHBondContact O-CG 3.1Å; R486-E490 PolarHBondContact O-N 3.4Å; K487-E490 PolarHBondContact O-N 3.04Å; E490-A494 PolarHBondContact O-N 3.08Å; E490-A494 VanDerWaalsContact O-N 3.08Å
491	E	89	Confident	87.4	Confident	86 Å²	86	108.1 Å²	108.1	40%	0.402	51%	0.506	S	S	.	.	H	α-helix	trans	-66.5	-48	174.2	-169.2	179.6	157.3	0	0	112.8	K487 V488 R489 Y493 A494 R495	K487-E491 PolarHBondContact O-N 2.86Å; V488-E491 PolarHBondContact O-N 3.24Å; R489-E491 VanDerWaalsContact C-N 3.34Å; E491-Y493 VanDerWaalsContact C-N 3.27Å; E491-Y493 PolarHBondContact O-N 3.03Å; E491-A494 WeakPolarHBondContact O-CB 3.06Å; E491-A494 PolarHBondContact O-N 3.04Å; E491-R495 PolarHBondContact O-N 2.67Å; E491-R495 IonicContact OE1-CZ 2.78Å; E491-R495 IonicContact OE1-NE 3.92Å; E491-R495 PolarHBondContact OE1-NE 3.41Å; E491-R495 IonicContact OE1-NH2 3.84Å; E491-R495 PolarHBondContact OE1-NH2 2.75Å
492	N	88	Confident	87.8	Confident	80 Å²	80	107 Å²	107	43%	0.428	50%	0.498	S	S	.	.	H	α-helix	trans	-62	-34.6	177.6	-78.8	-16.5	0	0	0	112.5	V488 R496	V488-N492 WeakPolarHBondContact O-CB 2.91Å; V488-N492 PolarHBondContact O-N 2.93Å; N492-R496 WeakPolarHBondContact O-CG 3.47Å; N492-R496 PolarHBondContact O-N 3.18Å; N492-R496 VanDerWaalsContact O-N 3.16Å
493	Y	86.5	Confident	88	Confident	166 Å²	166	108.1 Å²	108.1	65%	0.651	50%	0.5	S	S	*	.	H	α-helix	trans	-67.6	-38.7	173	-174	-101.4	0	0	0	112	R489 E491 R497	R489-Y493 WeakPolarHBondContact O-CB 3.41Å; R489-Y493 PolarHBondContact O-N 3.18Å; E491-Y493 VanDerWaalsContact C-N 3.27Å; E491-Y493 PolarHBondContact O-N 3.03Å; Y493-R497 WeakPolarHBondContact O-CB 3.47Å; Y493-R497 PolarHBondContact O-N 2.77Å
494	A	88.6	Confident	88.3	Confident	59 Å²	59	110.7 Å²	110.7	49%	0.488	51%	0.505	S	S	.	.	H	α-helix	trans	-65.9	-43.2	176	0	0	0	0	0	112.5	E490 E491 R497 F498	E490-A494 PolarHBondContact O-N 3.08Å; E490-A494 VanDerWaalsContact O-N 3.08Å; E491-A494 WeakPolarHBondContact O-CB 3.06Å; E491-A494 PolarHBondContact O-N 3.04Å; A494-R497 PolarHBondContact O-N 3.18Å; A494-F498 PolarHBondContact O-N 3Å; A494-F498 VanDerWaalsContact O-N 3.13Å
495	R	90.9	Very high	88.5	Confident	140 Å²	140	117.4 Å²	117.4	53%	0.528	52%	0.524	S	S	.	.	H	α-helix	trans	-58.9	-52.9	175.5	-68.4	-177	-172.9	-158.9	4.9	111.6	E491 R497 F498 E499	E491-R495 PolarHBondContact O-N 2.67Å; E491-R495 IonicContact OE1-CZ 2.78Å; E491-R495 IonicContact OE1-NE 3.92Å; E491-R495 PolarHBondContact OE1-NE 3.41Å; E491-R495 IonicContact OE1-NH2 3.84Å; E491-R495 PolarHBondContact OE1-NH2 2.75Å; R495-R497 VanDerWaalsContact C-N 3.3Å; R495-R497 PolarHBondContact O-N 2.96Å; R495-F498 WeakPolarHBondContact O-CA 3.34Å; R495-F498 WeakPolarHBondContact O-CB 3.35Å; R495-F498 PolarHBondContact O-N 2.95Å; R495-E499 WeakPolarHBondContact O-CG 3.49Å; R495-E499 PolarHBondContact O-N 3.23Å
496	R	88.3	Confident	88.9	Confident	89 Å²	89	118.1 Å²	118.1	34%	0.336	53%	0.526	S	S	.	.	H	α-helix	trans	-61.1	-35.4	178.3	-73.4	179.2	172.6	-149.3	6.1	114	Q184 N492 F498 E499 I500	Q184-R496 VanDerWaalsContact CD-CZ 3.45Å; Q184-R496 VanDerWaalsContact CD-NH2 3.34Å; Q184-R496 VanDerWaalsContact OE1-CZ 3.22Å; N492-R496 WeakPolarHBondContact O-CG 3.47Å; N492-R496 PolarHBondContact O-N 3.18Å; N492-R496 VanDerWaalsContact O-N 3.16Å; R496-F498 VanDerWaalsContact C-N 3.31Å; R496-E499 WeakPolarHBondContact CA-OE2 3.43Å; R496-E499 PolarHBondContact O-N 3.11Å; R496-I500 WeakPolarHBondContact O-CD1 3.45Å; R496-I500 VanDerWaalsContact O-CG1 3.26Å; R496-I500 WeakPolarHBondContact O-CG1 3.29Å; R496-I500 PolarHBondContact O-N 3.25Å
497	R	87.2	Confident	88.8	Confident	161 Å²	161	114.5 Å²	114.5	61%	0.608	52%	0.517	S	S	*	.	H	α-helix	trans	-62.5	-41.5	173.7	-176.6	-178.1	168.9	-140.1	-14.7	111.1	Y493 A494 R495 E501	Y493-R497 WeakPolarHBondContact O-CB 3.47Å; Y493-R497 PolarHBondContact O-N 2.77Å; A494-R497 PolarHBondContact O-N 3.18Å; R495-R497 VanDerWaalsContact C-N 3.3Å; R495-R497 PolarHBondContact O-N 2.96Å; R497-E501 IonicContact NH2-OE2 2.85Å; R497-E501 WeakPolarHBondContact O-CB 3.3Å; R497-E501 PolarHBondContact O-N 3.46Å
498	F	90.6	Very high	88.6	Confident	139 Å²	139	111 Å²	111	61%	0.61	51%	0.511	S	S	*	.	H	α-helix	trans	-66.8	-43.9	177	-172.2	-91	0	0	0	111.8	A494 R495 R496 I500 E501 E502	A494-F498 PolarHBondContact O-N 3Å; A494-F498 VanDerWaalsContact O-N 3.13Å; R495-F498 WeakPolarHBondContact O-CA 3.34Å; R495-F498 WeakPolarHBondContact O-CB 3.35Å; R495-F498 PolarHBondContact O-N 2.95Å; R496-F498 VanDerWaalsContact C-N 3.31Å; F498-I500 PolarHBondContact O-N 2.82Å; F498-E501 PolarHBondContact O-N 3.48Å; F498-E502 WeakPolarHBondContact O-CB 3.37Å; F498-E502 PolarHBondContact O-N 3.22Å
499	E	91.3	Very high	88.3	Confident	109 Å²	109	110.5 Å²	110.5	51%	0.509	51%	0.511	S	S	.	.	H	α-helix	trans	-57.9	-45.3	175.5	-69.6	155.7	-161.1	0	0	112.2	R495 R496 E502 H503	R495-E499 WeakPolarHBondContact O-CG 3.49Å; R495-E499 PolarHBondContact O-N 3.23Å; R496-E499 WeakPolarHBondContact CA-OE2 3.43Å; R496-E499 PolarHBondContact O-N 3.11Å; E499-E502 PolarHBondContact O-N 2.83Å; E499-H503 WeakPolarHBondContact O-CB 3.35Å; E499-H503 PolarHBondContact O-N 3.09Å
500	I	89.9	Confident	87.8	Confident	104 Å²	104	110.5 Å²	110.5	53%	0.533	52%	0.519	S	S	.	.	H	α-helix	trans	-65.3	-41.8	176.5	-67.6	165.1	0	0	0	111.1	R496 F498 E502 H503 L504	R496-I500 WeakPolarHBondContact O-CD1 3.45Å; R496-I500 VanDerWaalsContact O-CG1 3.26Å; R496-I500 WeakPolarHBondContact O-CG1 3.29Å; R496-I500 PolarHBondContact O-N 3.25Å; F498-I500 PolarHBondContact O-N 2.82Å; I500-E502 VanDerWaalsContact C-N 3.34Å; I500-H503 PolarHBondContact O-N 3.45Å; I500-L504 HydrophobicContact CG2-CD1 4.01Å; I500-L504 HydrophobicContact CG2-CG 4.45Å; I500-L504 WeakPolarHBondContact O-CB 3.34Å; I500-L504 VanDerWaalsContact O-CG 3.3Å; I500-L504 WeakPolarHBondContact O-CG 3.34Å; I500-L504 PolarHBondContact O-N 3.38Å
501	E	90.7	Very high	87	Confident	111 Å²	111	112.3 Å²	112.3	52%	0.519	53%	0.527	S	S	.	.	H	α-helix	trans	-65.6	-37.1	177.7	-167.4	168.9	160.8	0	0	111.5	R497 F498 R505	R497-E501 IonicContact NH2-OE2 2.85Å; R497-E501 WeakPolarHBondContact O-CB 3.3Å; R497-E501 PolarHBondContact O-N 3.46Å; F498-E501 PolarHBondContact O-N 3.48Å; E501-R505 WeakPolarHBondContact O-CB 3.42Å; E501-R505 PolarHBondContact O-N 3.34Å
502	E	91.5	Very high	85.9	Confident	82 Å²	82	112.3 Å²	112.3	38%	0.383	54%	0.536	S	S	.	.	H	α-helix	trans	-67.6	-43.1	172.8	-165.7	-172.9	149.9	0	0	112.2	F498 E499 I500 R505 K506	F498-E502 WeakPolarHBondContact O-CB 3.37Å; F498-E502 PolarHBondContact O-N 3.22Å; E499-E502 PolarHBondContact O-N 2.83Å; I500-E502 VanDerWaalsContact C-N 3.34Å; E502-R505 WeakPolarHBondContact O-CB 3.48Å; E502-R505 PolarHBondContact O-N 2.75Å; E502-K506 WeakPolarHBondContact O-CG 3.47Å; E502-K506 PolarHBondContact O-N 2.97Å; E502-K506 WeakPolarHBondContact OE1-CE 3.47Å; E502-K506 IonicContact OE1-NZ 3.34Å; E502-K506 PolarHBondContact OE1-NZ 3.23Å
503	H	89	Confident	84.6	Confident	119 Å²	119	112.4 Å²	112.4	55%	0.551	54%	0.544	S	S	*	.	H	α-helix	trans	-63.8	-43.5	177.6	-165.9	-82.4	0	0	0	111.8	E499 I500 R505 K506 M507	E499-H503 WeakPolarHBondContact O-CB 3.35Å; E499-H503 PolarHBondContact O-N 3.09Å; I500-H503 PolarHBondContact O-N 3.45Å; H503-R505 VanDerWaalsContact C-N 3.29Å; H503-R505 PolarHBondContact O-N 3.26Å; H503-K506 PolarHBondContact O-N 3.23Å; H503-M507 WeakPolarHBondContact O-CG 3.23Å; H503-M507 PolarHBondContact O-N 3.08Å
504	L	89.9	Confident	83.1	Confident	113 Å²	113	108.9 Å²	108.9	59%	0.592	54%	0.543	S	S	*	.	H	α-helix	trans	-61.8	-37.1	173.4	-71.9	171.4	0	0	0	112	I500 S508	I500-L504 HydrophobicContact CG2-CD1 4.01Å; I500-L504 HydrophobicContact CG2-CG 4.45Å; I500-L504 WeakPolarHBondContact O-CB 3.34Å; I500-L504 VanDerWaalsContact O-CG 3.3Å; I500-L504 WeakPolarHBondContact O-CG 3.34Å; I500-L504 PolarHBondContact O-N 3.38Å; L504-S508 WeakPolarHBondContact O-CB 3.47Å; L504-S508 PolarHBondContact O-N 2.99Å
505	R	89.3	Confident	81.6	Confident	201 Å²	201	115.6 Å²	115.6	76%	0.758	56%	0.562	S	S	*	*	H	α-helix	trans	-65.5	-42.1	175.1	-163.8	-178.3	-144.2	155.1	8.1	112.3	E501 E502 H503 S508 S509	E501-R505 WeakPolarHBondContact O-CB 3.42Å; E501-R505 PolarHBondContact O-N 3.34Å; E502-R505 WeakPolarHBondContact O-CB 3.48Å; E502-R505 PolarHBondContact O-N 2.75Å; H503-R505 VanDerWaalsContact C-N 3.29Å; H503-R505 PolarHBondContact O-N 3.26Å; R505-S508 PolarHBondContact O-N 2.72Å; R505-S509 PolarHBondContact O-N 3.35Å; R505-S509 PolarHBondContact O-OG 3.24Å
506	K	91.3	Very high	80	Confident	113 Å²	113	113.4 Å²	113.4	49%	0.491	57%	0.568	S	S	.	*	H	α-helix	trans	-61.9	-49.5	174.9	-73	172.2	-177.2	166.9	0	111.1	E502 H503 S508 S509 L510	E502-K506 WeakPolarHBondContact O-CG 3.47Å; E502-K506 PolarHBondContact O-N 2.97Å; E502-K506 WeakPolarHBondContact OE1-CE 3.47Å; E502-K506 IonicContact OE1-NZ 3.34Å; E502-K506 PolarHBondContact OE1-NZ 3.23Å; H503-K506 PolarHBondContact O-N 3.23Å; K506-S508 PolarHBondContact O-N 2.81Å; K506-S509 PolarHBondContact O-N 2.93Å; K506-S509 VanDerWaalsContact O-N 3.17Å; K506-S509 PolarHBondContact O-OG 3.28Å; K506-L510 PolarHBondContact O-N 2.76Å; K506-L510 VanDerWaalsContact O-N 3.17Å
507	M	82.2	Confident	78.5	Confident	89 Å²	89	117.5 Å²	117.5	44%	0.438	59%	0.591	S	S	.	*	H	α-helix	trans	-57.7	-47.3	176.1	-68.8	-64.1	-69	0	0	112.2	H503 S509 L510 E511	H503-M507 WeakPolarHBondContact O-CG 3.23Å; H503-M507 PolarHBondContact O-N 3.08Å; M507-S509 VanDerWaalsContact C-N 3.27Å; M507-S509 PolarHBondContact O-N 2.91Å; M507-L510 PolarHBondContact O-N 3.23Å; M507-L510 VanDerWaalsContact O-N 3.08Å; M507-E511 PolarHBondContact O-N 2.99Å; M507-E511 VanDerWaalsContact O-N 3.11Å
508	S	85.1	Confident	76.9	Confident	73 Å²	73	115.3 Å²	115.3	51%	0.51	60%	0.6	S	S	.	*	H	α-helix	trans	-61.8	-32.8	178.1	-178.4	0	0	0	0	113.3	L504 R505 K506 S512	L504-S508 WeakPolarHBondContact O-CB 3.47Å; L504-S508 PolarHBondContact O-N 2.99Å; R505-S508 PolarHBondContact O-N 2.72Å; K506-S508 PolarHBondContact O-N 2.81Å; S508-S512 PolarHBondContact O-N 2.68Å; S508-S512 PolarHBondContact O-OG 2.96Å
509	S	81.8	Confident	75	Confident	67 Å²	67	114.2 Å²	114.2	47%	0.469	61%	0.61	S	S	.	*	H	α-helix	trans	-72.3	-28.2	174.7	68.1	0	0	0	0	113.8	R505 K506 M507 S512 S513	R505-S509 PolarHBondContact O-N 3.35Å; R505-S509 PolarHBondContact O-OG 3.24Å; K506-S509 PolarHBondContact O-N 2.93Å; K506-S509 VanDerWaalsContact O-N 3.17Å; K506-S509 PolarHBondContact O-OG 3.28Å; M507-S509 VanDerWaalsContact C-N 3.27Å; M507-S509 PolarHBondContact O-N 2.91Å; S509-S512 PolarHBondContact O-OG 2.79Å; S509-S513 WeakPolarHBondContact O-CB 3.31Å; S509-S513 PolarHBondContact O-N 3.05Å
510	L	75.8	Confident	73.3	Confident	114 Å²	114	116.7 Å²	116.7	60%	0.597	63%	0.627	S	S	*	*	H	α-helix	trans	-75.8	-43	175.9	-69.1	169.2	0	0	0	111.6	K506 M507 S512 S513 S514	K506-L510 PolarHBondContact O-N 2.76Å; K506-L510 VanDerWaalsContact O-N 3.17Å; M507-L510 PolarHBondContact O-N 3.23Å; M507-L510 VanDerWaalsContact O-N 3.08Å; L510-S512 VanDerWaalsContact C-N 3.25Å; L510-S512 PolarHBondContact O-N 2.68Å; L510-S513 PolarHBondContact O-N 2.83Å; L510-S513 VanDerWaalsContact O-N 3.14Å; L510-S514 PolarHBondContact O-N 2.95Å; L510-S514 PolarHBondContact O-OG 3.36Å
511	E	71.2	Confident	71.7	Confident	144 Å²	144	117.2 Å²	117.2	67%	0.673	64%	0.64	S	S	*	*	H	α-helix	trans	-63	-30.3	176.6	-69	-175.9	159.8	0	0	113.1	M507	M507-E511 PolarHBondContact O-N 2.99Å; M507-E511 VanDerWaalsContact O-N 3.11Å
512	S	64.4	Low	70	Confident	85 Å²	85	119.3 Å²	119.3	59%	0.594	65%	0.654	S	S	*	*	H	α-helix	trans	-85.6	-13	176.2	45.8	0	0	0	0	114	S508 S509 L510	S508-S512 PolarHBondContact O-N 2.68Å; S508-S512 PolarHBondContact O-OG 2.96Å; S509-S512 PolarHBondContact O-OG 2.79Å; L510-S512 VanDerWaalsContact C-N 3.25Å; L510-S512 PolarHBondContact O-N 2.68Å
513	S	60.9	Low	68.3	Low	83 Å²	83	123.9 Å²	123.9	58%	0.58	68%	0.68	S	S	*	*	H	α-helix	trans	-88	-23.6	176.5	-175	0	0	0	0	113.8	S509 L510	S509-S513 WeakPolarHBondContact O-CB 3.31Å; S509-S513 PolarHBondContact O-N 3.05Å; L510-S513 PolarHBondContact O-N 2.83Å; L510-S513 VanDerWaalsContact O-N 3.14Å
514	S	56	Low	66.8	Low	92 Å²	92	123.4 Å²	123.4	64%	0.643	69%	0.691	S	S	*	*	S	Bend	trans	-93.8	2.5	-169.4	61	0	0	0	0	115.3	L510	L510-S514 PolarHBondContact O-N 2.95Å; L510-S514 PolarHBondContact O-OG 3.36Å
515	F	57.2	Low	65.1	Low	199 Å²	199	126.9 Å²	126.9	87%	0.873	70%	0.704	S	S	*	*	S	Bend	trans	-112	11	-171.6	-145.4	-95.8	0	0	0	115.4
516	S	56.8	Low	63.4	Low	95 Å²	95	127.4 Å²	127.4	66%	0.664	71%	0.712	S	S	*	*	S	Bend	trans	-122.9	-1.3	-172.8	45.2	0	0	0	0	116.7
517	E	56.7	Low	61.4	Low	174 Å²	174	133.9 Å²	133.9	81%	0.813	73%	0.733	S	S	*	*	S	Bend	trans	-136.4	74.6	-178.9	-70.1	-176	116.9	0	0	112.5
518	S	54	Low	60	Low	115 Å²	115	139.4 Å²	139.4	80%	0.804	76%	0.755	S	S	*	*	S	Bend	trans	174.2	47.6	156	41.7	0	0	0	0	115.3
519	S	51.1	Low	58.4	Low	117 Å²	117	145.2 Å²	145.2	82%	0.818	77%	0.774	S	S	*	*	S	Bend	trans	-163.4	107.4	165.6	-79.9	0	0	0	0	112.2
520	D	55.3	Low	56.8	Low	161 Å²	161	153.3 Å²	153.3	86%	0.861	79%	0.794	S	S	*	*	S	Bend	trans	163.5	-3.6	132.5	-99.5	-17.2	0	0	0	115.3	D522	D520-D522 PolarHBondContact O-N 3.11Å
521	S	55.7	Low	55.5	Low	114 Å²	114	159.8 Å²	159.8	80%	0.797	81%	0.811	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-9.3	-168.5	43.2	0	0	0	0	117.8
522	D	55.8	Low	54.2	Low	155 Å²	155	162 Å²	162	83%	0.829	82%	0.821	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.7	13.6	-160.9	-123.4	-14.4	0	0	0	116.9	D520	D520-D522 PolarHBondContact O-N 3.11Å
523	L	55.6	Low	53.4	Low	178 Å²	178	163.5 Å²	163.5	93%	0.932	83%	0.831	S	S	*	*	S	Bend	trans	-120.8	5.8	-179.5	-71	178.9	0	0	0	115.6
524	S	57.4	Low	53	Low	110 Å²	110	165.2 Å²	165.2	77%	0.769	84%	0.843	S	S	*	*	S	Bend	trans	-93.4	-15.1	-175.6	58.9	0	0	0	0	115.2
525	E	53.9	Low	52.7	Low	186 Å²	186	165.6 Å²	165.6	87%	0.869	85%	0.846	S	S	*	*	S	Bend	trans	-100.1	-2.8	-164.3	-157.8	157.6	-144.4	0	0	116.1
526	K	53	Low	52.2	Low	212 Å²	212	163.3 Å²	163.3	92%	0.922	84%	0.843	S	S	*	*	S	Bend	trans	-110.6	21.5	-172.6	-121	169	-171.5	165.4	0	117.1
527	R	50.1	Low	51.8	Low	248 Å²	248	163.3 Å²	163.3	94%	0.936	84%	0.843	S	S	*	*	S	Bend	trans	-130.5	26.5	-175.4	-147.6	177.1	-176.9	179.9	1.4	115.7
528	K	52	Low	51.2	Low	206 Å²	206	162.6 Å²	162.6	90%	0.896	84%	0.844	S	S	*	*			trans	-113.5	-3.3	-173.9	-130.8	173.8	-176.2	177.1	0	116.7
529	E	51.9	Low	50.9	Low	194 Å²	194	161.7 Å²	161.7	91%	0.907	84%	0.838	S	S	*	*	S	Bend	trans	-112.7	62.3	-177.6	-66	-170.8	136.5	0	0	113.7
530	R	48.3	Very low	50.9	Low	238 Å²	238	160.5 Å²	160.5	90%	0.898	83%	0.83	S	S	*	*	S	Bend	trans	-168	72.4	166.1	-122.2	171.1	166.8	-165.9	-4.5	113.2
531	R	48.3	Very low	50.5	Low	250 Å²	250	163 Å²	163	94%	0.943	83%	0.827	S	S	*	*			trans	173.1	83.8	156.3	-95.6	149.9	-172.9	-149.2	0.1	111
532	Q	43	Very low	50.2	Low	191 Å²	191	167.9 Å²	167.9	89%	0.893	83%	0.828	S	S	*	*			trans	-137.5	106.9	156.5	-71.7	-166.1	6.2	0	0	107.9
533	S	48.8	Very low	49.8	Very low	115 Å²	115	172.1 Å²	172.1	80%	0.804	83%	0.832	S	S	*	*			trans	-172.8	123.4	165.4	-90.7	0	0	0	0	107.4
534	S	51.6	Low	49	Very low	120 Å²	120	166.8 Å²	166.8	84%	0.839	82%	0.82	S	S	*	*			trans	55.8	147.3	171.2	66.8	0	0	0	0	119.3
535	S	50.8	Low	48.5	Very low	100 Å²	100	167.8 Å²	167.8	70%	0.699	83%	0.828	S	S	*	*			cis	-169.9	149.6	-33.1	44.6	0	0	0	0	109.1
536	N	45.5	Very low	47.9	Very low	151 Å²	151	162.4 Å²	162.4	81%	0.807	82%	0.822	S	S	*	*			trans	71.6	127.1	152.5	-80.8	11.6	0	0	0	122.6
537	S	49.3	Very low	47.6	Very low	95 Å²	95	158.2 Å²	158.2	66%	0.664	82%	0.819	S	S	*	*			trans	78.8	110.9	133	58.7	0	0	0	0	120.5
538	N	44.6	Very low	47.5	Very low	158 Å²	158	150 Å²	150	85%	0.845	81%	0.805	S	S	*	*				57.6	140.8	125.2	-64.8	-7.7	0	0	0	119.8
539	S	47.8	Very low	47.2	Very low	96 Å²	96	146.6 Å²	146.6	67%	0.671	80%	0.801	S	S	*	*			cis	-170.3	172.5	-13.6	59.8	0	0	0	0	107.2
540	S	50.3	Low	47.1	Very low	92 Å²	92	141.6 Å²	141.6	64%	0.643	79%	0.788	S	S	*	*			trans	42.7	120.6	145.8	162.9	0	0	0	0	118.6
541	R	47.2	Very low	47	Very low	215 Å²	215	136.2 Å²	136.2	81%	0.811	78%	0.781	S	S	*	*			cis	176.2	144.2	26.4	-106.1	169	-177.3	179	-0.2	107.3
542	R	48.4	Very low	47	Very low	215 Å²	215	130.9 Å²	130.9	81%	0.811	78%	0.777	S	S	*	*			trans	62	120.5	136.5	-69.4	-176.4	165.6	-167.1	-3.7	122.4
543	R	47.6	Very low	47.4	Very low	244 Å²	244	126 Å²	126	92%	0.921	76%	0.764	S	S	*	*			trans	49.1	124.9	130.1	-70.3	-176.2	169.5	-178.3	-4.4	119.9
544	G	40.1	Very low	47.5	Very low	66 Å²	66	131.7 Å²	131.7	68%	0.68	77%	0.768	S	S	*	*				136.9	105	118.5	0	0	0	0	0	118.2
545	S	47	Very low	47.3	Very low	132 Å²	132	136.8 Å²	136.8	92%	0.923	77%	0.769	S	S	*	*			trans	46	124.3	137.2	56	0	0	0	0	122.1
546	G	40.2	Very low	47.1	Very low	73 Å²	73	136.9 Å²	136.9	75%	0.753	77%	0.769	S	S	*	*			trans	148.1	102.7	165	0	0	0	0	0	109.3
547	S	47.3	Very low	47.1	Very low	123 Å²	123	133.2 Å²	133.2	86%	0.86	77%	0.767	S	S	*	*				82.2	134	64	-170.1	0	0	0	0	113.9
548	A	46.9	Very low	46.9	Very low	77 Å²	77	134.1 Å²	134.1	64%	0.636	77%	0.773	S	S	*	*			trans	87.5	127.7	159.9	0	0	0	0	0	121.3
549	T	46.5	Very low	47	Very low	133 Å²	133	131.5 Å²	131.5	82%	0.816	77%	0.767	S	S	*	*			trans	69.5	156	137	51.4	0	0	0	0	121.3
550	S	49.3	Very low	46.9	Very low	89 Å²	89	131.9 Å²	131.9	62%	0.622	77%	0.77	S	S	*	*			cis	-175.7	144.7	-36.3	50.8	0	0	0	0	110
551	T	46.5	Very low	46.6	Very low	125 Å²	125	133.6 Å²	133.6	77%	0.767	78%	0.782	S	S	*	*			trans	48.2	126.1	149.9	56.8	0	0	0	0	121.9
552	T	47.8	Very low	46.4	Very low	138 Å²	138	128.8 Å²	128.8	85%	0.847	78%	0.782	S	S	*	*			trans	-177.9	163.7	133.9	28	0	0	0	0	108.4
553	S	51.9	Low	46.5	Very low	88 Å²	88	124.6 Å²	124.6	62%	0.615	79%	0.785	S	S	*	*				178	138.5	-66.3	53.4	0	0	0	0	108.7
554	R	50.4	Low	46.2	Very low	236 Å²	236	117.9 Å²	117.9	89%	0.891	78%	0.775	S	S	*	*			trans	73.8	154	164.5	-59.8	168.3	174.6	-173.4	-3	115.3
555	R	47.4	Very low	46.4	Very low	227 Å²	227	121.2 Å²	121.2	86%	0.857	78%	0.783	S	S	*	*			cis	-157.9	158.4	16	-141.3	175.2	175.9	-175.2	-3.7	113
556	S	47.7	Very low	46.3	Very low	101 Å²	101	122.7 Å²	122.7	71%	0.706	78%	0.78	S	S	*	*			trans	-6	141.8	157	54.5	0	0	0	0	120
557	G	45.1	Very low	46.3	Very low	74 Å²	74	123 Å²	123	76%	0.763	78%	0.784	S	S	*	*				99.8	139.8	66.4	0	0	0	0	0	109.4
558	S	45	Very low	46.2	Very low	114 Å²	114	122.9 Å²	122.9	80%	0.797	78%	0.783	S	S	*	*			cis	-165.8	170.7	38.2	50.1	0	0	0	0	114.2
559	S	47.2	Very low	46.2	Very low	103 Å²	103	125.1 Å²	125.1	72%	0.72	79%	0.794	S	S	*	*			trans	-28.5	166.6	156.9	51.7	0	0	0	0	118.8
560	S	44.5	Very low	45.9	Very low	104 Å²	104	122.6 Å²	122.6	73%	0.727	79%	0.794	S	S	*	*			cis	173.3	148	-10.9	52.6	0	0	0	0	109
561	S	44.4	Very low	45.7	Very low	128 Å²	128	129.7 Å²	129.7	90%	0.895	81%	0.808	S	S	*	*			trans	176.8	156.9	144	52	0	0	0	0	113.6
562	S	44	Very low	45.6	Very low	115 Å²	115	130.7 Å²	130.7	80%	0.804	81%	0.808	S	S	*	*			trans	-110.3	151	-176.6	52.1	0	0	0	0	112.9
563	S	49	Very low	45.6	Very low	126 Å²	126	133.7 Å²	133.7	88%	0.881	81%	0.812	S	S	*	*			trans	-164.6	146.2	138.5	54.1	0	0	0	0	112.6
564	S	41.6	Very low	45.1	Very low	103 Å²	103	137.8 Å²	137.8	72%	0.72	82%	0.822	S	S	*	*			trans	-97.7	154.3	175.6	50.2	0	0	0	0	111.7
565	T	45.5	Very low	44.9	Very low	136 Å²	136	137.5 Å²	137.5	83%	0.834	82%	0.821	S	S	*	*				-177.1	159.7	121.6	29.3	0	0	0	0	113.5
566	D	44	Very low	45	Very low	163 Å²	163	138.2 Å²	138.2	87%	0.872	82%	0.824	S	S	*	*			trans	-51.4	163	-178	-57.2	-72.9	0	0	0	118.9
567	G	40.5	Very low	45	Very low	80 Å²	80	142 Å²	142	83%	0.825	83%	0.83	S	S	*	*			trans	179.9	112.5	163.8	0	0	0	0	0	112.8
568	S	44.8	Very low	44.9	Very low	121 Å²	121	147.6 Å²	147.6	85%	0.846	84%	0.836	S	S	*	*			trans	-92	174.9	-171.3	-168.5	0	0	0	0	114.5
569	S	47	Very low	45.1	Very low	124 Å²	124	153.2 Å²	153.2	87%	0.867	84%	0.84	S	S	*	*			trans	86.8	142.1	167.4	82.7	0	0	0	0	118.7
570	G	41	Very low	45.1	Very low	80 Å²	80	156.5 Å²	156.5	83%	0.825	84%	0.844	S	S	*	*			trans	147.2	66.8	176.1	0	0	0	0	0	115.2
571	R	43.9	Very low	45.2	Very low	238 Å²	238	159.2 Å²	159.2	90%	0.898	85%	0.845	S	S	*	*			trans	-68.7	161.3	171.8	-84.1	-179	173.2	172	-2.8	111.8
572	N	44.6	Very low	45.3	Very low	145 Å²	145	159 Å²	159	78%	0.775	84%	0.84	S	S	*	*			trans	72.2	95.3	162.7	-63.7	-12.9	0	0	0	118.2
573	Q	47.4	Very low	46	Very low	201 Å²	201	159 Å²	159	94%	0.939	84%	0.835	S	S	*	*				-150.1	94.5	124.1	-115.6	171.4	81	0	0	111.1
574	Q	41.4	Very low	46.3	Very low	175 Å²	175	161.2 Å²	161.2	82%	0.818	83%	0.831	S	S	*	*			trans	-68	162	163.9	-73.4	179.7	-29.7	0	0	110.4
575	R	46.8	Very low	46.9	Very low	230 Å²	230	163.7 Å²	163.7	87%	0.868	83%	0.832	S	S	*	*			trans	68	83.3	166.9	-61.8	175.6	157.8	-155	-5.7	117
576	R	48.6	Very low	47.2	Very low	242 Å²	242	161.4 Å²	161.4	91%	0.913	83%	0.826	S	S	*	*			trans	-173	167.3	134	-97.8	145.2	-170.8	-151.1	1.2	109.7
577	Q	47.8	Very low	47.7	Very low	181 Å²	181	164 Å²	164	85%	0.846	82%	0.824	S	S	*	*			trans	71.8	55.8	178.1	-44.5	-57.7	-0.5	0	0	117.3
578	H	44.1	Very low	48.4	Very low	190 Å²	190	170.5 Å²	170.5	88%	0.88	82%	0.823	S	S	*	*			trans	-100.3	75.9	164.6	-162.4	-6.6	0	0	0	110.2
579	R	49.1	Very low	48.9	Very low	233 Å²	233	172.2 Å²	172.2	88%	0.879	82%	0.818	S	S	*	*			trans	-179.7	154.7	164.3	-105	161.3	-176.3	-167.3	0.2	110.4
580	Q	47.2	Very low	49.5	Very low	172 Å²	172	172.7 Å²	172.7	80%	0.804	81%	0.811	S	S	*	*			trans	79.1	96.1	177.4	-47	-170.6	29.8	0	0	117.1
581	H	46.3	Very low	50.1	Low	161 Å²	161	176.4 Å²	176.4	75%	0.745	80%	0.801	S	S	*	*				161.4	84.9	126.1	-91.5	-70.3	0	0	0	113.8
582	P	47.5	Very low	51.3	Low	122 Å²	122	169.4 Å²	169.4	79%	0.792	79%	0.786	S	S	*	*			trans	-105.4	60.6	172.9	39	-30.8	0	0	0	112.3
583	V	58.7	Low	52.4	Low	116 Å²	116	170.9 Å²	170.9	70%	0.703	78%	0.782	S	S	*	*	S	Bend	trans	-135.5	-20.1	179.9	-173.8	0	0	0	0	114.3
584	Q	55.3	Low	53.6	Low	173 Å²	173	170.1 Å²	170.1	81%	0.808	77%	0.771	S	S	*	*	S	Bend	trans	-99.4	-7	-177.5	-65	-163.9	6.7	0	0	115.2
585	Q	53.1	Low	55.4	Low	155 Å²	155	166.1 Å²	166.1	72%	0.724	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-83	-33.5	-175.2	-148	153	-7.7	0	0	112.7	R587 R588	Q585-R587 PolarHBondContact O-N 3.27Å; Q585-R588 PolarHBondContact O-N 2.84Å
586	A	53	Low	56.9	Low	87 Å²	87	157.3 Å²	157.3	72%	0.719	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-68.6	1.3	-178.6	0	0	0	0	0	116
587	R	54.4	Low	58.6	Low	217 Å²	217	149 Å²	149	82%	0.819	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-101.5	-2.4	175.3	-83	-169.6	172.6	-167.7	-1.9	114.7	Q585	Q585-R587 PolarHBondContact O-N 3.27Å
588	R	54.2	Low	60.3	Low	218 Å²	218	145.5 Å²	145.5	82%	0.823	69%	0.692	S	S	*	*	S	Bend	trans	-95.5	-17.8	180	-76.5	-172.3	170	-167.1	-2.8	114.8	Q585	Q585-R588 PolarHBondContact O-N 2.84Å
589	E	56	Low	62.3	Low	157 Å²	157	144.9 Å²	144.9	73%	0.734	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-11	-171.9	-68	171.8	-176.7	0	0	114.3	P592	E589-P592 VanDerWaalsContact O-CD 3.25Å; E589-P592 WeakPolarHBondContact O-CD 3.46Å
590	N	58.3	Low	64	Low	133 Å²	133	138.6 Å²	138.6	71%	0.711	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	14.5	-174.7	-143	-13.6	0	0	0	114.6
591	Y	55	Low	66.1	Low	159 Å²	159	133.4 Å²	133.4	62%	0.624	65%	0.646	S	S	*	*	S	Bend	trans	-87.3	-26.5	175.5	-89.9	-87.2	0	0	0	117.5
592	P	67.6	Low	68.2	Low	90 Å²	90	130.2 Å²	130.2	58%	0.584	63%	0.631	S	S	*	*	H	α-helix	trans	-70.6	-35.3	-175.2	26.7	-31.4	0	0	0	112.5	E589 R594 N595 A596	E589-P592 VanDerWaalsContact O-CD 3.25Å; E589-P592 WeakPolarHBondContact O-CD 3.46Å; P592-R594 PolarHBondContact O-N 2.86Å; P592-N595 PolarHBondContact O-N 3.05Å; P592-A596 PolarHBondContact O-N 3.13Å
593	Y	69	Low	70.2	Confident	177 Å²	177	128.1 Å²	128.1	69%	0.694	61%	0.614	S	S	*	*	H	α-helix	trans	-64.8	-42.6	-175.7	-157.6	-96.4	0	0	0	112.9	N595 A596 V597	Y593-N595 VanDerWaalsContact C-N 3.25Å; Y593-N595 PolarHBondContact O-N 2.88Å; Y593-A596 PolarHBondContact O-N 2.88Å; Y593-A596 VanDerWaalsContact O-N 3.16Å; Y593-V597 HydrophobicContact CD1-CG2 4.18Å; Y593-V597 HydrophobicContact CE1-CG2 4.01Å; Y593-V597 PolarHBondContact O-N 2.91Å
594	R	73	Confident	71.8	Confident	184 Å²	184	127.1 Å²	127.1	69%	0.694	61%	0.607	S	S	*	*	H	α-helix	trans	-63.2	-31.7	177.5	-169.8	176.6	-178.1	-173.3	1.1	112.7	P592 M598	P592-R594 PolarHBondContact O-N 2.86Å; R594-M598 VanDerWaalsContact O-CG 3.26Å; R594-M598 WeakPolarHBondContact O-CG 3.24Å; R594-M598 PolarHBondContact O-N 3.45Å
595	N	78.5	Confident	73.6	Confident	92 Å²	92	125.5 Å²	125.5	49%	0.492	60%	0.598	S	S	.	*	H	α-helix	trans	-76.8	-28	177.4	-72.9	-18.8	0	0	0	112.7	P592 Y593 R599	P592-N595 PolarHBondContact O-N 3.05Å; Y593-N595 VanDerWaalsContact C-N 3.25Å; Y593-N595 PolarHBondContact O-N 2.88Å; N595-R599 WeakPolarHBondContact O-CG 3.38Å; N595-R599 PolarHBondContact O-N 3.02Å
596	A	78.5	Confident	75.5	Confident	44 Å²	44	124.2 Å²	124.2	36%	0.364	59%	0.586	S	S	.	*	H	α-helix	trans	-67.7	-56.3	172.6	0	0	0	0	0	110.7	P592 Y593 M598 R599 D600	P592-A596 PolarHBondContact O-N 3.13Å; Y593-A596 PolarHBondContact O-N 2.88Å; Y593-A596 VanDerWaalsContact O-N 3.16Å; A596-M598 PolarHBondContact O-N 2.92Å; A596-M598 VanDerWaalsContact O-N 3.12Å; A596-R599 WeakPolarHBondContact O-CA 3.42Å; A596-R599 WeakPolarHBondContact O-CB 3.3Å; A596-R599 PolarHBondContact O-N 2.93Å; A596-D600 PolarHBondContact O-N 2.91Å; A596-D600 VanDerWaalsContact O-N 3.13Å
597	V	83.1	Confident	77.2	Confident	68 Å²	68	122.9 Å²	122.9	41%	0.412	58%	0.575	S	S	.	*	H	α-helix	trans	-55.8	-36.6	-179.7	178.5	0	0	0	0	112.3	Y593 V601	Y593-V597 HydrophobicContact CD1-CG2 4.18Å; Y593-V597 HydrophobicContact CE1-CG2 4.01Å; Y593-V597 PolarHBondContact O-N 2.91Å; V597-V601 VanDerWaalsContact O-CG2 3.3Å; V597-V601 WeakPolarHBondContact O-CG2 3.31Å; V597-V601 PolarHBondContact O-N 2.76Å; V597-V601 VanDerWaalsContact O-N 3.14Å
598	M	84.1	Confident	79	Confident	108 Å²	108	115.7 Å²	115.7	53%	0.532	56%	0.556	S	S	.	*	H	α-helix	trans	-68.7	-30.6	176.2	-74.4	-65.5	-59.4	0	0	113.8	R594 A596 E602	R594-M598 VanDerWaalsContact O-CG 3.26Å; R594-M598 WeakPolarHBondContact O-CG 3.24Å; R594-M598 PolarHBondContact O-N 3.45Å; A596-M598 PolarHBondContact O-N 2.92Å; A596-M598 VanDerWaalsContact O-N 3.12Å; M598-E602 PolarHBondContact O-N 2.93Å
599	R	85.6	Confident	80.9	Confident	177 Å²	177	110.4 Å²	110.4	67%	0.668	54%	0.543	S	S	*	.	H	α-helix	trans	-70.6	-46.9	173.2	-70.3	176	-165.3	179.3	4.6	110.9	N595 A596 V601 E602 D603	N595-R599 WeakPolarHBondContact O-CG 3.38Å; N595-R599 PolarHBondContact O-N 3.02Å; A596-R599 WeakPolarHBondContact O-CA 3.42Å; A596-R599 WeakPolarHBondContact O-CB 3.3Å; A596-R599 PolarHBondContact O-N 2.93Å; R599-V601 PolarHBondContact O-N 2.99Å; R599-E602 CarbonylContact O-C 3.6Å; R599-E602 WeakPolarHBondContact O-CA 3.36Å; R599-E602 WeakPolarHBondContact O-CB 3.42Å; R599-E602 PolarHBondContact O-N 2.9Å; R599-D603 PolarHBondContact O-N 2.87Å
600	D	86.8	Confident	82.6	Confident	100 Å²	100	111.2 Å²	111.2	54%	0.535	54%	0.539	S	S	.	.	H	α-helix	trans	-57.5	-41.4	179.7	-55.7	-25.9	0	0	0	111.1	A596 E602 D603 V604	A596-D600 PolarHBondContact O-N 2.91Å; A596-D600 VanDerWaalsContact O-N 3.13Å; D600-E602 VanDerWaalsContact C-N 3.35Å; D600-E602 PolarHBondContact O-N 2.9Å; D600-D603 PolarHBondContact O-N 3.13Å; D600-V604 WeakPolarHBondContact O-CB 3.42Å; D600-V604 VanDerWaalsContact O-CG2 3.3Å; D600-V604 WeakPolarHBondContact O-CG2 3.49Å; D600-V604 PolarHBondContact O-N 3.09Å
601	V	89.8	Confident	84.1	Confident	63 Å²	63	110.6 Å²	110.6	38%	0.382	53%	0.532	S	S	.	.	H	α-helix	trans	-65.2	-33.1	174.4	170.6	0	0	0	0	112.9	V597 R599 K605	V597-V601 VanDerWaalsContact O-CG2 3.3Å; V597-V601 WeakPolarHBondContact O-CG2 3.31Å; V597-V601 PolarHBondContact O-N 2.76Å; V597-V601 VanDerWaalsContact O-N 3.14Å; R599-V601 PolarHBondContact O-N 2.99Å; V601-K605 HydrophobicContact CG1-CD 4.48Å; V601-K605 WeakPolarHBondContact O-CD 3.41Å; V601-K605 VanDerWaalsContact O-CG 3.24Å; V601-K605 WeakPolarHBondContact O-CG 3.24Å; V601-K605 PolarHBondContact O-N 3.41Å
602	E	91.2	Very high	85.9	Confident	94 Å²	94	111 Å²	111	44%	0.439	53%	0.532	S	S	.	.	H	α-helix	trans	-72.5	-42	172.5	-81.5	-164.2	-162.8	0	0	112.5	M598 R599 D600 K605 R606	M598-E602 PolarHBondContact O-N 2.93Å; R599-E602 CarbonylContact O-C 3.6Å; R599-E602 WeakPolarHBondContact O-CA 3.36Å; R599-E602 WeakPolarHBondContact O-CB 3.42Å; R599-E602 PolarHBondContact O-N 2.9Å; D600-E602 VanDerWaalsContact C-N 3.35Å; D600-E602 PolarHBondContact O-N 2.9Å; E602-K605 WeakPolarHBondContact O-CB 3.39Å; E602-K605 PolarHBondContact O-N 2.8Å; E602-K605 VanDerWaalsContact O-N 3.14Å; E602-R606 WeakPolarHBondContact O-CG 3.16Å; E602-R606 PolarHBondContact O-N 2.83Å; E602-R606 IonicContact OE2-CZ 3.42Å; E602-R606 IonicContact OE2-NH2 3.22Å; E602-R606 PolarHBondContact OE2-NH2 3Å
603	D	90.1	Very high	87	Confident	79 Å²	79	112 Å²	112	42%	0.422	53%	0.529	S	S	.	.	H	α-helix	trans	-71.2	-35.7	-177.8	-70.9	-35	0	0	0	111.6	R599 D600 K605 R606 A607	R599-D603 PolarHBondContact O-N 2.87Å; D600-D603 PolarHBondContact O-N 3.13Å; D603-K605 VanDerWaalsContact C-N 3.32Å; D603-K605 PolarHBondContact O-N 2.8Å; D603-R606 PolarHBondContact O-N 3.02Å; D603-R606 WeakPolarHBondContact OD1-CD 3.44Å; D603-R606 IonicContact OD1-CZ 2.7Å; D603-R606 IonicContact OD1-NE 2.64Å; D603-R606 IonicContact OD1-NH1 3.52Å; D603-R606 PolarHBondContact OD1-NH1 3.05Å; D603-A607 WeakPolarHBondContact O-CB 3.23Å; D603-A607 PolarHBondContact O-N 2.92Å
604	V	91.1	Very high	88	Confident	95 Å²	95	108.6 Å²	108.6	58%	0.576	52%	0.518	S	S	*	.	H	α-helix	trans	-60.3	-39.3	167.7	170.5	0	0	0	0	111.8	D600 T608	D600-V604 WeakPolarHBondContact O-CB 3.42Å; D600-V604 VanDerWaalsContact O-CG2 3.3Å; D600-V604 WeakPolarHBondContact O-CG2 3.49Å; D600-V604 PolarHBondContact O-N 3.09Å; V604-T608 WeakPolarHBondContact O-CB 3.43Å; V604-T608 PolarHBondContact O-N 2.88Å; V604-T608 PolarHBondContact O-OG1 3.24Å
605	K	94.2	Very high	88.9	Confident	138 Å²	138	106.4 Å²	106.4	60%	0.6	51%	0.51	S	S	*	.	H	α-helix	trans	-66	-41.8	174.7	-75.4	167.7	-175.6	170.2	0	111.8	V601 E602 D603 T608 L609	V601-K605 HydrophobicContact CG1-CD 4.48Å; V601-K605 WeakPolarHBondContact O-CD 3.41Å; V601-K605 VanDerWaalsContact O-CG 3.24Å; V601-K605 WeakPolarHBondContact O-CG 3.24Å; V601-K605 PolarHBondContact O-N 3.41Å; E602-K605 WeakPolarHBondContact O-CB 3.39Å; E602-K605 PolarHBondContact O-N 2.8Å; E602-K605 VanDerWaalsContact O-N 3.14Å; D603-K605 VanDerWaalsContact C-N 3.32Å; D603-K605 PolarHBondContact O-N 2.8Å; K605-T608 PolarHBondContact O-N 2.82Å; K605-L609 WeakPolarHBondContact O-CB 3.49Å; K605-L609 PolarHBondContact O-N 3.05Å
606	R	92.3	Very high	89.5	Confident	128 Å²	128	111.2 Å²	111.2	48%	0.483	52%	0.521	S	S	.	.	H	α-helix	trans	-64.7	-45.4	176.6	-68.3	170.2	-164.9	171.9	0.8	111.4	E602 D603 T608 L609 R610	E602-R606 WeakPolarHBondContact O-CG 3.16Å; E602-R606 PolarHBondContact O-N 2.83Å; E602-R606 IonicContact OE2-CZ 3.42Å; E602-R606 IonicContact OE2-NH2 3.22Å; E602-R606 PolarHBondContact OE2-NH2 3Å; D603-R606 PolarHBondContact O-N 3.02Å; D603-R606 WeakPolarHBondContact OD1-CD 3.44Å; D603-R606 IonicContact OD1-CZ 2.7Å; D603-R606 IonicContact OD1-NE 2.64Å; D603-R606 IonicContact OD1-NH1 3.52Å; D603-R606 PolarHBondContact OD1-NH1 3.05Å; R606-T608 PolarHBondContact O-N 3.48Å; R606-L609 PolarHBondContact O-N 2.87Å; R606-R610 WeakPolarHBondContact O-CG 3.15Å; R606-R610 PolarHBondContact O-N 3.11Å
607	A	89.5	Confident	90.1	Very high	59 Å²	59	114.9 Å²	114.9	49%	0.488	53%	0.531	S	S	.	.	H	α-helix	trans	-59.9	-45.2	175.2	0	0	0	0	0	111.7	D603 L609 R610 H611	D603-A607 WeakPolarHBondContact O-CB 3.23Å; D603-A607 PolarHBondContact O-N 2.92Å; A607-L609 VanDerWaalsContact C-N 3.3Å; A607-L609 PolarHBondContact O-N 2.7Å; A607-R610 PolarHBondContact O-N 3.46Å; A607-H611 PolarHBondContact O-N 3.43Å
608	T	91.5	Very high	90.4	Very high	67 Å²	67	113.8 Å²	113.8	41%	0.411	52%	0.523	S	S	.	.	H	α-helix	trans	-60.9	-38	175.7	-56.9	0	0	0	0	112.2	V604 K605 R606 R612	V604-T608 WeakPolarHBondContact O-CB 3.43Å; V604-T608 PolarHBondContact O-N 2.88Å; V604-T608 PolarHBondContact O-OG1 3.24Å; K605-T608 PolarHBondContact O-N 2.82Å; R606-T608 PolarHBondContact O-N 3.48Å; T608-R612 WeakPolarHBondContact O-CG 3.42Å; T608-R612 PolarHBondContact O-N 3.11Å; T608-R612 VanDerWaalsContact O-N 3.13Å
609	L	94.2	Very high	90.8	Very high	106 Å²	106	113.5 Å²	113.5	56%	0.555	52%	0.523	S	S	*	.	H	α-helix	trans	-67.9	-45.2	176.3	-171.9	66.9	0	0	0	111.9	K605 R606 A607 H611 R612 Q613	K605-L609 WeakPolarHBondContact O-CB 3.49Å; K605-L609 PolarHBondContact O-N 3.05Å; R606-L609 PolarHBondContact O-N 2.87Å; A607-L609 VanDerWaalsContact C-N 3.3Å; A607-L609 PolarHBondContact O-N 2.7Å; L609-H611 PolarHBondContact O-N 3.38Å; L609-R612 PolarHBondContact O-N 2.97Å; L609-Q613 PolarHBondContact O-N 2.76Å
610	R	91.6	Very high	91.1	Very high	175 Å²	175	107.6 Å²	107.6	66%	0.66	51%	0.512	S	S	*	.	H	α-helix	trans	-58.6	-46	174.5	-70.4	-177.8	-174.1	-174.9	3.3	111.4	R606 A607 R612 Q613 F614	R606-R610 WeakPolarHBondContact O-CG 3.15Å; R606-R610 PolarHBondContact O-N 3.11Å; A607-R610 PolarHBondContact O-N 3.46Å; R610-R612 VanDerWaalsContact C-N 3.31Å; R610-R612 PolarHBondContact O-N 3.39Å; R610-Q613 PolarHBondContact O-N 3.33Å; R610-Q613 VanDerWaalsContact O-N 3.1Å; R610-F614 PolarHBondContact O-N 3.31Å
611	H	90	Very high	91.4	Very high	119 Å²	119	108.2 Å²	108.2	55%	0.551	51%	0.512	S	S	*	.	H	α-helix	trans	-60.8	-38.1	177.4	-171.7	63.4	0	0	0	112.6	A607 L609 R615	A607-H611 PolarHBondContact O-N 3.43Å; L609-H611 PolarHBondContact O-N 3.38Å; H611-R615 PolarHBondContact O-N 3.38Å
612	R	91.4	Very high	91.5	Very high	167 Å²	167	108.7 Å²	108.7	63%	0.63	51%	0.512	S	S	*	.	H	α-helix	trans	-67.1	-35.5	173.8	-75.7	178.4	176.2	-172.9	-0.4	113	T608 L609 R610 R616	T608-R612 WeakPolarHBondContact O-CG 3.42Å; T608-R612 PolarHBondContact O-N 3.11Å; T608-R612 VanDerWaalsContact O-N 3.13Å; L609-R612 PolarHBondContact O-N 2.97Å; R610-R612 VanDerWaalsContact C-N 3.31Å; R610-R612 PolarHBondContact O-N 3.39Å; R612-R616 WeakPolarHBondContact O-CG 3.48Å; R612-R616 PolarHBondContact O-N 3.11Å
613	Q	91.6	Very high	91.5	Very high	111 Å²	111	106.7 Å²	106.7	52%	0.519	51%	0.511	S	S	.	.	H	α-helix	trans	-68.6	-45.7	174.1	-73.1	177.2	-32.4	0	0	111.4	L609 R610 R615 R616 Q617	L609-Q613 PolarHBondContact O-N 2.76Å; R610-Q613 PolarHBondContact O-N 3.33Å; R610-Q613 VanDerWaalsContact O-N 3.1Å; Q613-R615 PolarHBondContact O-N 3.19Å; Q613-R616 PolarHBondContact O-N 3.39Å; Q613-R616 VanDerWaalsContact O-N 3.14Å; Q613-Q617 PolarHBondContact O-N 3.31Å
614	F	90.7	Very high	91.6	Very high	106 Å²	106	108.1 Å²	108.1	47%	0.465	52%	0.518	S	S	.	.	H	α-helix	trans	-61.6	-39	178.2	-173	-107.9	0	0	0	112.8	R610 Q617 N618	R610-F614 PolarHBondContact O-N 3.31Å; F614-Q617 PolarHBondContact O-N 3.22Å; F614-N618 WeakPolarHBondContact CD1-ND2 3.24Å; F614-N618 WeakPolarHBondContact CE1-ND2 3.32Å; F614-N618 VanDerWaalsContact CZ-ND2 3.3Å; F614-N618 WeakPolarHBondContact CZ-ND2 3.38Å; F614-N618 PolarHBondContact O-N 3.45Å; F614-N618 PolarHBondContact O-ND2 3.32Å
615	R	90.8	Very high	91.6	Very high	139 Å²	139	104.4 Å²	104.4	53%	0.525	50%	0.497	S	S	.	.	H	α-helix	trans	-59.9	-49.3	171.2	-75.3	-167.1	-169.9	-151.5	2.4	112	H611 Q613 Q617 N618 D619	H611-R615 PolarHBondContact O-N 3.38Å; Q613-R615 PolarHBondContact O-N 3.19Å; R615-Q617 VanDerWaalsContact C-N 3.26Å; R615-Q617 PolarHBondContact O-N 3.24Å; R615-N618 PolarHBondContact O-N 2.88Å; R615-N618 VanDerWaalsContact O-N 3.15Å; R615-D619 WeakPolarHBondContact O-CB 3.4Å; R615-D619 PolarHBondContact O-N 3.06Å
616	R	91.7	Very high	91.6	Very high	192 Å²	192	102.3 Å²	102.3	73%	0.725	49%	0.491	S	S	*	.	H	α-helix	trans	-59.4	-34.6	179	-72.2	175.5	179	-174.6	-1.2	113.1	R612 Q613 A620	R612-R616 WeakPolarHBondContact O-CG 3.48Å; R612-R616 PolarHBondContact O-N 3.11Å; Q613-R616 PolarHBondContact O-N 3.39Å; Q613-R616 VanDerWaalsContact O-N 3.14Å; R616-A620 WeakPolarHBondContact O-CB 3.49Å; R616-A620 PolarHBondContact O-N 3.12Å; R616-A620 VanDerWaalsContact O-N 3.15Å
617	Q	90.3	Very high	91.6	Very high	122 Å²	122	100.8 Å²	100.8	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-68.8	-48.8	173.9	-74.2	176.3	-47.4	0	0	111.7	Q613 F614 R615 D619 A620 E621	Q613-Q617 PolarHBondContact O-N 3.31Å; F614-Q617 PolarHBondContact O-N 3.22Å; R615-Q617 VanDerWaalsContact C-N 3.26Å; R615-Q617 PolarHBondContact O-N 3.24Å; Q617-D619 PolarHBondContact O-N 3.27Å; Q617-A620 PolarHBondContact O-N 3.25Å; Q617-E621 PolarHBondContact O-N 3.43Å
618	N	90.5	Very high	91.7	Very high	45 Å²	45	103.1 Å²	103.1	24%	0.241	50%	0.5	C	S	.	.	H	α-helix	trans	-60.2	-43	176	-78.4	-81.4	0	0	0	112.4	F614 R615 A620 E621 I622	F614-N618 WeakPolarHBondContact CD1-ND2 3.24Å; F614-N618 WeakPolarHBondContact CE1-ND2 3.32Å; F614-N618 VanDerWaalsContact CZ-ND2 3.3Å; F614-N618 WeakPolarHBondContact CZ-ND2 3.38Å; F614-N618 PolarHBondContact O-N 3.45Å; F614-N618 PolarHBondContact O-ND2 3.32Å; R615-N618 PolarHBondContact O-N 2.88Å; R615-N618 VanDerWaalsContact O-N 3.15Å; N618-A620 VanDerWaalsContact C-N 3.29Å; N618-A620 PolarHBondContact O-N 3.32Å; N618-E621 PolarHBondContact O-N 2.98Å; N618-I622 WeakPolarHBondContact O-CB 3.49Å; N618-I622 VanDerWaalsContact O-CG1 3.24Å; N618-I622 WeakPolarHBondContact O-CG1 3.47Å; N618-I622 PolarHBondContact O-N 3.31Å
619	D	92.4	Very high	91.6	Very high	101 Å²	101	104.5 Å²	104.5	54%	0.54	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-37.8	178.1	-64.5	-27.6	0	0	0	111	R615 Q617 A623	R615-D619 WeakPolarHBondContact O-CB 3.4Å; R615-D619 PolarHBondContact O-N 3.06Å; Q617-D619 PolarHBondContact O-N 3.27Å; D619-A623 WeakPolarHBondContact O-CB 3.31Å; D619-A623 PolarHBondContact O-N 3.08Å
620	A	91.6	Very high	91.4	Very high	53 Å²	53	106.4 Å²	106.4	44%	0.438	51%	0.511	S	S	.	.	H	α-helix	trans	-70.5	-40.1	175	0	0	0	0	0	113.1	R616 Q617 N618 A623 L624	R616-A620 WeakPolarHBondContact O-CB 3.49Å; R616-A620 PolarHBondContact O-N 3.12Å; R616-A620 VanDerWaalsContact O-N 3.15Å; Q617-A620 PolarHBondContact O-N 3.25Å; N618-A620 VanDerWaalsContact C-N 3.29Å; N618-A620 PolarHBondContact O-N 3.32Å; A620-A623 PolarHBondContact O-N 2.8Å; A620-L624 WeakPolarHBondContact O-CB 3.23Å; A620-L624 PolarHBondContact O-N 3.01Å
621	E	92.2	Very high	91.3	Very high	114 Å²	114	102.6 Å²	102.6	53%	0.533	51%	0.511	S	S	.	.	H	α-helix	trans	-66	-38.6	174.5	-75.6	-176.3	-159.8	0	0	112.4	Q617 N618 L624 A625	Q617-E621 PolarHBondContact O-N 3.43Å; N618-E621 PolarHBondContact O-N 2.98Å; E621-L624 PolarHBondContact O-N 3.31Å; E621-A625 WeakPolarHBondContact O-CB 3.46Å; E621-A625 PolarHBondContact O-N 3.48Å
622	I	91.9	Very high	91.1	Very high	73 Å²	73	103.9 Å²	103.9	37%	0.374	52%	0.521	S	S	.	.	H	α-helix	trans	-65	-44	174	-69.8	165.5	0	0	0	110	N618 A625 I626	N618-I622 WeakPolarHBondContact O-CB 3.49Å; N618-I622 VanDerWaalsContact O-CG1 3.24Å; N618-I622 WeakPolarHBondContact O-CG1 3.47Å; N618-I622 PolarHBondContact O-N 3.31Å; I622-A625 PolarHBondContact O-N 3.39Å; I622-I626 HydrophobicContact CG2-CD1 3.9Å; I622-I626 VanDerWaalsContact O-CG1 3.3Å; I622-I626 WeakPolarHBondContact O-CG1 3.36Å; I622-I626 PolarHBondContact O-N 3.38Å
623	A	92.5	Very high	90.6	Very high	51 Å²	51	108.1 Å²	108.1	42%	0.421	54%	0.539	S	S	.	.	H	α-helix	trans	-60.9	-44.9	175.3	0	0	0	0	0	112.2	D619 A620 A625 I626 V627	D619-A623 WeakPolarHBondContact O-CB 3.31Å; D619-A623 PolarHBondContact O-N 3.08Å; A620-A623 PolarHBondContact O-N 2.8Å; A623-A625 PolarHBondContact O-N 2.8Å; A623-I626 PolarHBondContact O-N 3.25Å; A623-V627 WeakPolarHBondContact O-CG2 3.49Å; A623-V627 PolarHBondContact O-N 3.44Å
624	L	92.6	Very high	90.5	Very high	109 Å²	109	108 Å²	108	57%	0.571	54%	0.54	S	S	*	.	H	α-helix	trans	-60.6	-42.8	174	-96.7	162.8	0	0	0	112.3	A620 E621 I626 V627 L628	A620-L624 WeakPolarHBondContact O-CB 3.23Å; A620-L624 PolarHBondContact O-N 3.01Å; E621-L624 PolarHBondContact O-N 3.31Å; L624-I626 VanDerWaalsContact C-N 3.32Å; L624-I626 PolarHBondContact O-N 3.26Å; L624-V627 PolarHBondContact O-N 3.08Å; L624-L628 WeakPolarHBondContact O-CB 3.35Å; L624-L628 WeakPolarHBondContact O-CG 3.41Å; L624-L628 PolarHBondContact O-N 2.93Å
625	A	90.6	Very high	90.5	Very high	17 Å²	17	108.1 Å²	108.1	14%	0.14	54%	0.544	C	S	.	.	H	α-helix	trans	-64.6	-35.5	176.8	0	0	0	0	0	112.4	E621 I622 A623 N629	E621-A625 WeakPolarHBondContact O-CB 3.46Å; E621-A625 PolarHBondContact O-N 3.48Å; I622-A625 PolarHBondContact O-N 3.39Å; A623-A625 PolarHBondContact O-N 2.8Å; A625-N629 PolarHBondContact O-N 3.07Å; A625-N629 VanDerWaalsContact O-N 3.08Å; A625-N629 PolarHBondContact O-ND2 3.45Å
626	I	93	Very high	90.5	Very high	94 Å²	94	106.4 Å²	106.4	48%	0.482	55%	0.545	S	S	.	.	H	α-helix	trans	-67	-46.1	174.6	-69.4	164.8	0	0	0	110.3	I622 A623 L624 L628 N629 H630	I622-I626 HydrophobicContact CG2-CD1 3.9Å; I622-I626 VanDerWaalsContact O-CG1 3.3Å; I622-I626 WeakPolarHBondContact O-CG1 3.36Å; I622-I626 PolarHBondContact O-N 3.38Å; A623-I626 PolarHBondContact O-N 3.25Å; L624-I626 VanDerWaalsContact C-N 3.32Å; L624-I626 PolarHBondContact O-N 3.26Å; I626-L628 PolarHBondContact O-N 2.96Å; I626-N629 PolarHBondContact O-N 3.26Å; I626-H630 WeakPolarHBondContact O-CB 3.48Å; I626-H630 PolarHBondContact O-CD2 3.09Å; I626-H630 PolarHBondContact O-N 3.18Å
627	V	93.4	Very high	90.4	Very high	97 Å²	97	101.4 Å²	101.4	59%	0.588	53%	0.534	S	S	*	.	H	α-helix	trans	-62	-43.6	177.7	172.2	0	0	0	0	111.7	A623 L624 H630 S631	A623-V627 WeakPolarHBondContact O-CG2 3.49Å; A623-V627 PolarHBondContact O-N 3.44Å; L624-V627 PolarHBondContact O-N 3.08Å; V627-H630 CarbonylContact O-C 3.57Å; V627-H630 PolarHBondContact O-N 2.97Å; V627-S631 PolarHBondContact O-N 3.27Å; V627-S631 VanDerWaalsContact O-N 3.07Å
628	L	92.2	Very high	90.4	Very high	108 Å²	108	100.1 Å²	100.1	57%	0.565	53%	0.532	S	S	*	.	H	α-helix	trans	-65.7	-39.2	178	-72.9	170.8	0	0	0	112.6	L624 I626 S631 L632	L624-L628 WeakPolarHBondContact O-CB 3.35Å; L624-L628 WeakPolarHBondContact O-CG 3.41Å; L624-L628 PolarHBondContact O-N 2.93Å; I626-L628 PolarHBondContact O-N 2.96Å; L628-S631 PolarHBondContact O-N 3.25Å; L628-L632 PolarHBondContact O-N 3.19Å
629	N	89.2	Confident	90.4	Very high	96 Å²	96	103.7 Å²	103.7	51%	0.513	55%	0.552	S	S	.	*	H	α-helix	trans	-65.4	-40.7	173	-81.1	-78.5	0	0	0	111.4	A625 I626 S631 L632 Y633	A625-N629 PolarHBondContact O-N 3.07Å; A625-N629 VanDerWaalsContact O-N 3.08Å; A625-N629 PolarHBondContact O-ND2 3.45Å; I626-N629 PolarHBondContact O-N 3.26Å; N629-S631 PolarHBondContact O-N 3.44Å; N629-L632 PolarHBondContact O-N 3.34Å; N629-Y633 WeakPolarHBondContact O-CD2 3.39Å
630	H	90	Very high	90.3	Very high	146 Å²	146	103.9 Å²	103.9	68%	0.676	55%	0.552	S	S	*	*	H	α-helix	trans	-68.9	-10.1	175.6	-92.2	-75.2	0	0	0	114.8	I626 V627	I626-H630 WeakPolarHBondContact O-CB 3.48Å; I626-H630 PolarHBondContact O-CD2 3.09Å; I626-H630 PolarHBondContact O-N 3.18Å; V627-H630 CarbonylContact O-C 3.57Å; V627-H630 PolarHBondContact O-N 2.97Å
631	S	88.3	Confident	90.2	Very high	94 Å²	94	107.8 Å²	107.8	66%	0.657	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-1.9	174.1	-172	0	0	0	0	113.3	V627 L628 N629	V627-S631 PolarHBondContact O-N 3.27Å; V627-S631 VanDerWaalsContact O-N 3.07Å; L628-S631 PolarHBondContact O-N 3.25Å; N629-S631 PolarHBondContact O-N 3.44Å
632	L	86.6	Confident	90	Very high	147 Å²	147	107.3 Å²	107.3	77%	0.77	56%	0.564	S	S	*	*			trans	-108.3	2.1	176.9	-69.6	171.2	0	0	0	112.7	L628 N629	L628-L632 PolarHBondContact O-N 3.19Å; N629-L632 PolarHBondContact O-N 3.34Å
633	Y	79.8	Confident	89.8	Confident	256 Å²	256	110.5 Å²	110.5	100%	1.004	58%	0.581	S	S	*	*			trans	-118.8	0	167.7	-70.3	-81.8	0	0	0	109	N629	N629-Y633 WeakPolarHBondContact O-CD2 3.39Å

Retrieved 633 of 633 residues in 202.9 ms (Link to these results)

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