A0A077ZA66_TRITR Loading...

CUGBP Elav family like

AlphaFold DB , UniProt , Accession A0A077ZA66, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 408 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	49.6	Very low	51.1	Low	228 Å²	228	164.7 Å²	164.7	100%	1.123	86%	0.862	S	S	*	*				0	110.1	0	-78.1	56.3	174.1	0	0	108.6
2	N	57.6	Low	51.2	Low	173 Å²	173	159.4 Å²	159.4	93%	0.925	85%	0.849	S	S	*	*			trans	-176.2	122.9	160.4	-98.9	-36.5	0	0	0	107.5
3	R	59.4	Low	50.2	Low	242 Å²	242	157.2 Å²	157.2	91%	0.913	83%	0.83	S	S	*	*			trans	-113.1	136.7	173.7	-78.5	-176.7	175.2	-122.2	1.8	108.6
4	P	54	Low	49.3	Very low	127 Å²	127	157.1 Å²	157.1	83%	0.825	83%	0.83	S	S	*	*			trans	-70.4	141	-179.9	29.3	-34.3	0	0	0	111.2	Q6	P4-Q6 PolarHBondContact O-N 3.46Å
5	M	58.5	Low	48.5	Very low	185 Å²	185	160.5 Å²	160.5	91%	0.911	83%	0.828	S	S	*	*			trans	-82.6	110.5	179.2	-167.7	-177.5	-63.1	0	0	109.9
6	Q	52.4	Low	47.8	Very low	177 Å²	177	155.1 Å²	155.1	83%	0.827	82%	0.824	S	S	*	*			trans	-98.7	105.6	-176	-170.4	173.2	12.2	0	0	110.6	P4	P4-Q6 PolarHBondContact O-N 3.46Å
7	V	45	Very low	46.8	Very low	134 Å²	134	150.5 Å²	150.5	81%	0.812	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-76.9	123.6	171.5	-85.2	0	0	0	0	110.6
8	K	56.2	Low	46.1	Very low	186 Å²	186	147.6 Å²	147.6	81%	0.809	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-95.5	131.4	165.3	-82	-177.4	172.7	-179.6	0	109.2	A10	K8-A10 PolarHBondContact O-N 2.85Å
9	P	47.3	Very low	45.4	Very low	129 Å²	129	148.3 Å²	148.3	84%	0.838	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-68.2	120.9	159.3	29.2	-30.3	0	0	0	108.1	D11	P9-D11 PolarHBondContact O-N 3.46Å
10	A	45.9	Very low	44.8	Very low	89 Å²	89	153.3 Å²	153.3	74%	0.736	83%	0.828	S	S	*	*			trans	-84.2	100.3	174.3	0	0	0	0	0	109.1	K8	K8-A10 PolarHBondContact O-N 2.85Å
11	D	36.1	Very low	44.2	Very low	142 Å²	142	152 Å²	152	76%	0.759	83%	0.831	S	S	*	*			trans	-64.3	138.1	154.3	-161.4	-60.8	0	0	0	108.1	P9 E13	P9-D11 PolarHBondContact O-N 3.46Å; D11-E13 PolarHBondContact OD1-N 3.49Å
12	S	51.9	Low	43.5	Very low	101 Å²	101	150.1 Å²	150.1	71%	0.706	81%	0.813	S	S	*	*			trans	-151.9	61.7	-177.9	-69	0	0	0	0	110	N14	S12-N14 PolarHBondContact O-N 3.23Å
13	E	38.8	Very low	42.5	Very low	130 Å²	130	150.5 Å²	150.5	61%	0.607	81%	0.806	S	S	*	*			trans	-39.3	102.6	160.3	-172.1	-177	120.9	0	0	112.3	D11 R15	D11-E13 PolarHBondContact OD1-N 3.49Å; E13-R15 HydrophobicContact CG-CG 4.21Å; E13-R15 IonicContact OE1-CZ 3.11Å; E13-R15 IonicContact OE1-NE 2.64Å; E13-R15 PolarHBondContact OE1-NE 2.95Å; E13-R15 IonicContact OE1-NH2 2.76Å; E13-R15 PolarHBondContact OE1-NH2 3.38Å; E13-R15 IonicContact OE2-NH2 3.98Å
14	N	36.9	Very low	41.3	Very low	156 Å²	156	146.6 Å²	146.6	83%	0.834	80%	0.798	S	S	*	*			trans	-99.9	87	170.7	-168.8	10	0	0	0	110.4	S12 G16	S12-N14 PolarHBondContact O-N 3.23Å; N14-G16 PolarHBondContact O-N 3.49Å
15	R	37.8	Very low	40.4	Very low	209 Å²	209	145.7 Å²	145.7	79%	0.789	79%	0.79	S	S	*	*			trans	-67.3	116	168.3	-66.5	-172.2	-166.1	179.3	9.9	109.6	E13	E13-R15 HydrophobicContact CG-CG 4.21Å; E13-R15 IonicContact OE1-CZ 3.11Å; E13-R15 IonicContact OE1-NE 2.64Å; E13-R15 PolarHBondContact OE1-NE 2.95Å; E13-R15 IonicContact OE1-NH2 2.76Å; E13-R15 PolarHBondContact OE1-NH2 3.38Å; E13-R15 IonicContact OE2-NH2 3.98Å
16	G	37.6	Very low	39.2	Very low	74 Å²	74	145.5 Å²	145.5	76%	0.763	78%	0.784	S	S	*	*			trans	-158.4	80	179.1	0	0	0	0	0	115.3	N14	N14-G16 PolarHBondContact O-N 3.49Å
17	G	30.3	Very low	38.5	Very low	77 Å²	77	142.1 Å²	142.1	79%	0.794	78%	0.776	S	S	*	*			trans	96.3	86.7	147.4	0	0	0	0	0	119.4
18	A	34	Very low	38.1	Very low	98 Å²	98	141.5 Å²	141.5	81%	0.81	77%	0.774	S	S	*	*			trans	60	106.6	136.4	0	0	0	0	0	121.8
19	L	32.3	Very low	37.2	Very low	160 Å²	160	139.8 Å²	139.8	84%	0.838	76%	0.764	S	S	*	*				66.4	71.9	121.8	-153.4	154.2	0	0	0	118
20	W	34.6	Very low	37	Very low	248 Å²	248	141.3 Å²	141.3	94%	0.939	76%	0.76	S	S	*	*			trans	-141.4	99.4	140.8	-85.3	85.7	0	0	0	109.2	Y22	W20-Y22 PolarHBondContact O-N 3.42Å; W20-Y22 VanDerWaalsContact O-N 3.1Å
21	S	32.3	Very low	37.2	Very low	128 Å²	128	141 Å²	141	90%	0.895	75%	0.749	S	S	*	*			trans	-79.1	89.8	176.7	-173.5	0	0	0	0	110.1
22	Y	33.8	Very low	38	Very low	187 Å²	187	138.2 Å²	138.2	73%	0.733	74%	0.74	S	S	*	*			trans	-91.9	105.8	167.5	-153.4	-87.9	0	0	0	109.2	W20 Q24	W20-Y22 PolarHBondContact O-N 3.42Å; W20-Y22 VanDerWaalsContact O-N 3.1Å; Y22-Q24 VanDerWaalsContact C-N 3.32Å; Y22-Q24 PolarHBondContact O-N 3.46Å
23	K	36.9	Very low	38.1	Very low	181 Å²	181	139.4 Å²	139.4	79%	0.787	73%	0.734	S	S	*	*			trans	-65.1	94.8	170.3	-170.7	178.8	-175.7	-179.3	0	107.8	V25	K23-V25 PolarHBondContact O-N 2.99Å
24	Q	33.7	Very low	39	Very low	160 Å²	160	137.2 Å²	137.2	75%	0.748	73%	0.727	S	S	*	*			trans	-68.8	77.6	-175.2	-171.9	177.7	-5.4	0	0	111	Y22 K26	Y22-Q24 VanDerWaalsContact C-N 3.32Å; Y22-Q24 PolarHBondContact O-N 3.46Å; Q24-K26 PolarHBondContact O-N 3.23Å
25	V	36.9	Very low	40.8	Very low	108 Å²	108	132.9 Å²	132.9	66%	0.655	70%	0.698	S	S	*	*			trans	-69.6	101.2	166.4	-175.6	0	0	0	0	107	K23 T27	K23-V25 PolarHBondContact O-N 2.99Å; V25-T27 VanDerWaalsContact C-N 3.29Å; V25-T27 HydrophobicContact CG1-CG2 4.37Å; V25-T27 PolarHBondContact O-N 3.26Å
26	K	33.3	Very low	43.1	Very low	182 Å²	182	127.6 Å²	127.6	79%	0.791	68%	0.681	S	S	*	*			trans	-77.3	74.1	-174.3	-166.4	-179.6	-175.2	-178	0	110.2	Q24	Q24-K26 PolarHBondContact O-N 3.23Å
27	T	37.5	Very low	45.5	Very low	105 Å²	105	124.1 Å²	124.1	64%	0.644	65%	0.645	S	S	*	*			trans	-69.8	127.4	171.7	46.5	0	0	0	0	110	V25 Y29	V25-T27 VanDerWaalsContact C-N 3.29Å; V25-T27 HydrophobicContact CG1-CG2 4.37Å; V25-T27 PolarHBondContact O-N 3.26Å; T27-Y29 PolarHBondContact O-N 2.82Å
28	P	36.5	Very low	48.3	Very low	121 Å²	121	123.6 Å²	123.6	79%	0.786	62%	0.621	S	S	*	*			trans	-86.3	55.7	-174.8	36.4	-36.9	0	0	0	111.6
29	Y	35.7	Very low	50.8	Low	151 Å²	151	119 Å²	119	59%	0.592	58%	0.583	S	S	*	*			trans	-130.1	105.1	171	-87.8	-88.1	0	0	0	110	T27 V31 V375	T27-Y29 PolarHBondContact O-N 2.82Å; Y29-V31 VanDerWaalsContact C-N 3.3Å; Y29-V31 PolarHBondContact O-N 3.16Å; Y29-V375 HydrophobicContact CE1-CG2 4.08Å; Y29-V375 WeakPolarHBondContact OH-CG2 3.4Å
30	H	44.3	Very low	53.4	Low	161 Å²	161	111.4 Å²	111.4	75%	0.745	54%	0.544	S	S	*	.			trans	-70.3	87.5	170	-176.8	-90.4	0	0	0	108.4	S32	H30-S32 PolarHBondContact O-N 3.44Å
31	V	50.2	Low	55.7	Low	83 Å²	83	102 Å²	102	50%	0.503	51%	0.511	S	S	.	.			trans	-71.2	122.4	-177.4	-159.8	0	0	0	0	109.5	Y29	Y29-V31 VanDerWaalsContact C-N 3.3Å; Y29-V31 PolarHBondContact O-N 3.16Å
32	S	52.2	Low	58	Low	82 Å²	82	96 Å²	96	57%	0.573	47%	0.469	S	S	*	.			trans	-49.2	153.8	-172.5	-47.2	0	0	0	0	114.6	H30 D34	H30-S32 PolarHBondContact O-N 3.44Å; S32-D34 VanDerWaalsContact C-N 3.31Å; S32-D34 PolarHBondContact O-N 3.49Å
33	E	53.6	Low	60.1	Low	126 Å²	126	87.3 Å²	87.3	59%	0.589	44%	0.435	S	S	*	.	S	Bend	trans	-74.8	-0.4	-145.5	-62.6	-178	107.9	0	0	117.2
34	D	59	Low	61.8	Low	84 Å²	84	84.4 Å²	84.4	45%	0.449	42%	0.423	S	S	.	.			trans	-115.7	32.6	-165.5	-60.2	-55.4	0	0	0	116.3	S32 H98	S32-D34 VanDerWaalsContact C-N 3.31Å; S32-D34 PolarHBondContact O-N 3.49Å; D34-H98 WeakPolarHBondContact CB-ND1 3.41Å; D34-H98 IonicContact OD2-ND1 2.63Å
35	R	74.7	Confident	63.8	Low	65 Å²	65	84.7 Å²	84.7	25%	0.245	42%	0.424	C	S	.	.			trans	-95.5	-6.7	-175.4	-65.8	-165.5	-58.1	139.1	1.4	116.4	E62 R95 V96	R35-E62 IonicContact NH1-OE1 3.78Å; R35-E62 PolarHBondContact NH1-OE1 2.96Å; R35-E62 IonicContact NH1-OE2 2.64Å; R35-E62 PolarHBondContact NH1-OE2 3.46Å; R35-R95 VanDerWaalsContact O-CA 3.32Å; R35-R95 WeakPolarHBondContact O-CA 3.45Å; R35-V96 WeakPolarHBondContact CA-O 3.43Å; R35-V96 VanDerWaalsContact CB-O 3.29Å; R35-V96 WeakPolarHBondContact CB-O 3.42Å; R35-V96 WeakPolarHBondContact CG-O 3.35Å; R35-V96 PolarHBondContact O-N 3.39Å
36	K	85	Confident	65.7	Low	98 Å²	98	80.1 Å²	80.1	43%	0.426	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.6	-174	-70.5	-176.9	-179.8	-175.7	0	111.8	I93 F94 R95 A126	K36-I93 HydrophobicContact CB-CG2 4.26Å; K36-I93 HydrophobicContact CD-CG2 4.25Å; K36-I93 HydrophobicContact CG-CG2 4.33Å; K36-F94 VanDerWaalsContact CA-O 3.26Å; K36-F94 WeakPolarHBondContact CA-O 3.47Å; K36-R95 HydrophobicContact CG-CG 4.06Å; K36-A126 HydrophobicContact CB-CB 3.79Å; K36-A126 PolarHBondContact O-N 3.4Å
37	L	88.2	Confident	67.9	Low	1 Å²	1	73.4 Å²	73.4	1%	0.005	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	146.5	165.7	-68.9	-179.6	0	0	0	110.3	I93 F94 V96 A101 A104 I105 V123 K124 F125	L37-I93 CarbonylContact O-C 3.55Å; L37-I93 WeakPolarHBondContact O-CA 3.33Å; L37-F94 HydrophobicContact CB-CB 4.31Å; L37-F94 HydrophobicContact CB-CD2 4.39Å; L37-F94 PolarHBondContact N-O 3.22Å; L37-F94 PolarHBondContact O-N 3.22Å; L37-V96 HydrophobicContact CD1-CG2 4.02Å; L37-V96 HydrophobicContact CG-CG2 4.03Å; L37-A101 HydrophobicContact CD1-CB 4.49Å; L37-A101 HydrophobicContact CD2-CB 3.84Å; L37-A101 HydrophobicContact CG-CB 4.14Å; L37-A104 HydrophobicContact CD1-CB 3.83Å; L37-I105 HydrophobicContact CD2-CD1 3.59Å; L37-I105 HydrophobicContact CD2-CG1 3.67Å; L37-V123 HydrophobicContact CD1-CG1 4.18Å; L37-V123 HydrophobicContact CD2-CG1 4.49Å; L37-K124 CarbonylContact C-O 3.54Å; L37-K124 WeakPolarHBondContact CA-O 3Å; L37-K124 WeakPolarHBondContact CD2-O 3.4Å; L37-F125 HydrophobicContact CD2-CD1 4.4Å
38	F	88.9	Confident	70.2	Confident	67 Å²	67	72.9 Å²	72.9	29%	0.294	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	125.6	166.4	177.1	-88	0	0	0	108.2	N91 C92 I93 K124 A126	F38-N91 HydrophobicContact CD2-CB 4.31Å; F38-N91 HydrophobicContact CE1-CB 4.09Å; F38-N91 HydrophobicContact CE2-CB 3.48Å; F38-N91 VanDerWaalsContact CE2-CB 3.48Å; F38-N91 HydrophobicContact CZ-CB 3.37Å; F38-N91 WeakPolarHBondContact CZ-OD1 3.5Å; F38-C92 WeakPolarHBondContact CA-O 3.15Å; F38-I93 HydrophobicContact CD2-CG1 4.3Å; F38-K124 PolarHBondContact N-O 3.01Å; F38-K124 PolarHBondContact O-N 3.35Å; F38-A126 HydrophobicContact CB-CB 3.87Å
39	V	87.8	Confident	72.5	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.6	174.8	-179.8	0	0	0	0	109.4	L42 M55 N91 C92 F94 L121 V122 V123	V39-L42 HydrophobicContact CG1-CD2 4.06Å; V39-L42 HydrophobicContact CG1-CG 4.42Å; V39-M55 HydrophobicContact CG2-CE 3.89Å; V39-N91 CarbonylContact O-C 3.55Å; V39-N91 WeakPolarHBondContact O-CA 3.46Å; V39-C92 PolarHBondContact N-O 3.07Å; V39-C92 PolarHBondContact O-N 2.86Å; V39-F94 HydrophobicContact CB-CE2 4.07Å; V39-F94 HydrophobicContact CG2-CD2 3.89Å; V39-F94 HydrophobicContact CG2-CE2 3.53Å; V39-L121 HydrophobicContact CG1-CB 4.49Å; V39-L121 HydrophobicContact CG1-CD2 4.09Å; V39-V122 CarbonylContact C-O 3.55Å; V39-V122 VanDerWaalsContact CA-O 3.3Å; V39-V122 WeakPolarHBondContact CA-O 3.48Å; V39-V123 HydrophobicContact CB-CG2 4.44Å; V39-V123 HydrophobicContact CG1-CG2 4.02Å; V39-V123 HydrophobicContact CG2-CB 4.15Å; V39-V123 HydrophobicContact CG2-CG1 3.89Å; V39-V123 HydrophobicContact CG2-CG2 3.76Å
40	G	86.3	Confident	74.9	Confident	2 Å²	2	67.5 Å²	67.5	2%	0.021	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	178.3	178.1	0	0	0	0	0	113.9	L42 N91 V122	G40-L42 VanDerWaalsContact C-N 3.3Å; G40-N91 WeakPolarHBondContact CA-OD1 3.33Å; G40-V122 PolarHBondContact N-O 3.43Å; G40-V122 PolarHBondContact O-N 3.4Å
41	M	83	Confident	76.9	Confident	49 Å²	49	59.9 Å²	59.9	24%	0.241	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	66.6	24.6	-172.4	-50	-59.4	-173.7	0	0	114.5	K89 A117 S120 V122	M41-K89 HydrophobicContact CE-CD 4.33Å; M41-K89 HydrophobicContact SD-CD 3.56Å; M41-K89 VanDerWaalsContact SD-CD 3.56Å; M41-K89 WeakPolarHBondContact SD-CE 3.13Å; M41-K89 HydrophobicContact SD-CG 3.8Å; M41-A117 WeakPolarHBondContact O-CB 3.36Å; M41-S120 WeakPolarHBondContact CB-O 3.33Å; M41-V122 HydrophobicContact CE-CG2 4.15Å; M41-V122 HydrophobicContact CG-CB 4.27Å; M41-V122 HydrophobicContact CG-CG2 3.54Å
42	L	80.9	Confident	78.7	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.016	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	145.9	175.6	-55.2	166.1	0	0	0	110.9	V39 G40 Q46 L51 S90 C92 L121	V39-L42 HydrophobicContact CG1-CD2 4.06Å; V39-L42 HydrophobicContact CG1-CG 4.42Å; G40-L42 VanDerWaalsContact C-N 3.3Å; L42-Q46 HydrophobicContact CB-CB 4.48Å; L42-Q46 HydrophobicContact CB-CG 4.36Å; L42-L51 HydrophobicContact CD1-CD1 3.65Å; L42-L51 HydrophobicContact CD1-CD2 4.12Å; L42-L51 HydrophobicContact CD2-CD1 4.15Å; L42-L51 HydrophobicContact CD2-CD2 3.34Å; L42-L51 HydrophobicContact CD2-CG 4.27Å; L42-L51 HydrophobicContact CG-CD1 4.48Å; L42-L51 HydrophobicContact CG-CD2 4.37Å; L42-S90 WeakPolarHBondContact CB-O 3.45Å; L42-S90 WeakPolarHBondContact CG-O 3.34Å; L42-S90 PolarHBondContact N-O 3.32Å; L42-S90 PolarHBondContact O-N 2.85Å; L42-S90 VanDerWaalsContact O-N 3.13Å; L42-C92 HydrophobicContact CD1-CB 4.06Å; L42-L121 HydrophobicContact CD2-CD2 3.45Å; L42-L121 VanDerWaalsContact CD2-CD2 3.45Å; L42-L121 HydrophobicContact CG-CD2 4.45Å
43	S	77.3	Confident	80.4	Confident	4 Å²	4	64.9 Å²	64.9	3%	0.028	30%	0.298	C	S	.	.			trans	-67.4	160.3	172.8	95.2	0	0	0	0	111.3	Q45 Q46 P115 G116	S43-Q45 PolarHBondContact O-N 2.98Å; S43-Q45 PolarHBondContact OG-N 3.3Å; S43-Q46 PolarHBondContact O-N 2.88Å; S43-Q46 PolarHBondContact OG-N 3.4Å; S43-P115 WeakPolarHBondContact CB-O 3.36Å; S43-P115 PolarHBondContact OG-O 2.97Å; S43-G116 WeakPolarHBondContact CB-O 3.25Å
44	K	73.3	Confident	82	Confident	120 Å²	120	60 Å²	60	52%	0.522	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-26.2	175.1	-57.7	-164.1	-144.9	-172.9	0	112.8	R68 P88	K44-R68 PolarHBondContact O-NH1 3.44Å; K44-P88 HydrophobicContact CD-CB 3.97Å; K44-P88 HydrophobicContact CD-CG 4.03Å; K44-P88 VanDerWaalsContact CE-CG 3.42Å; K44-P88 HydrophobicContact CG-CB 3.88Å; K44-P88 HydrophobicContact CG-CG 4.46Å
45	Q	74.6	Confident	83.3	Confident	166 Å²	166	56.3 Å²	56.3	78%	0.776	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-15.6	-173.1	-70.6	169.2	-24.1	0	0	113	S43 A47	S43-Q45 PolarHBondContact O-N 2.98Å; S43-Q45 PolarHBondContact OG-N 3.3Å; Q45-A47 PolarHBondContact O-N 3.19Å
46	Q	76.4	Confident	83.9	Confident	12 Å²	12	59.6 Å²	59.6	6%	0.056	27%	0.274	C	S	.	.			trans	-56.5	127	178.7	-66.4	-54.1	-52.8	0	0	111.6	L42 S43 L51 R68 M114 P115	L42-Q46 HydrophobicContact CB-CB 4.48Å; L42-Q46 HydrophobicContact CB-CG 4.36Å; S43-Q46 PolarHBondContact O-N 2.88Å; S43-Q46 PolarHBondContact OG-N 3.4Å; Q46-L51 HydrophobicContact CB-CD1 4.3Å; Q46-R68 PolarHBondContact O-NH2 3.28Å; Q46-M114 HydrophobicContact CG-CB 4.19Å; Q46-P115 PolarHBondContact NE2-O 2.95Å
47	A	81	Confident	84	Confident	41 Å²	41	59.6 Å²	59.6	34%	0.339	28%	0.284	S	S	.	.			trans	-89.1	166.6	172.7	0	0	0	0	0	111	Q45 E49 D50 L51	Q45-A47 PolarHBondContact O-N 3.19Å; A47-E49 VanDerWaalsContact C-N 3.25Å; A47-E49 PolarHBondContact O-N 2.77Å; A47-D50 WeakPolarHBondContact CB-OD2 3.32Å; A47-D50 PolarHBondContact N-OD2 3.43Å; A47-L51 WeakPolarHBondContact O-CD1 3.4Å; A47-L51 PolarHBondContact O-N 2.79Å
48	E	84.3	Confident	83.9	Confident	94 Å²	94	62.1 Å²	62.1	44%	0.439	30%	0.296	S	S	.	.	H	α-helix	trans	-63.3	-35.4	173.7	-162	-179.3	130.5	0	0	111.8	L51 R52 C64 V66	E48-L51 WeakPolarHBondContact O-CB 3.19Å; E48-L51 PolarHBondContact O-N 3.39Å; E48-R52 WeakPolarHBondContact O-CB 3.47Å; E48-R52 PolarHBondContact O-N 3.44Å; E48-C64 HydrophobicContact CG-CB 3.64Å; E48-C64 VanDerWaalsContact CG-SG 3.52Å; E48-V66 HydrophobicContact CB-CG2 4.21Å; E48-V66 HydrophobicContact CG-CG2 4.46Å
49	E	85.7	Confident	83.7	Confident	92 Å²	92	59.6 Å²	59.6	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-65.5	-45.8	-179.9	179.8	62	-168.9	0	0	112.7	A47 L51 R52 R53	A47-E49 VanDerWaalsContact C-N 3.25Å; A47-E49 PolarHBondContact O-N 2.77Å; E49-L51 PolarHBondContact O-N 2.81Å; E49-R52 PolarHBondContact O-N 3.29Å; E49-R52 VanDerWaalsContact O-N 3.16Å; E49-R53 WeakPolarHBondContact O-CG 3.33Å; E49-R53 PolarHBondContact O-N 3.41Å; E49-R53 IonicContact OE1-CZ 2.71Å; E49-R53 IonicContact OE1-NE 3.21Å; E49-R53 PolarHBondContact OE1-NE 3.37Å; E49-R53 IonicContact OE1-NH2 3.23Å; E49-R53 PolarHBondContact OE1-NH2 3.05Å
50	D	86.7	Confident	83.5	Confident	68 Å²	68	64.7 Å²	64.7	36%	0.364	32%	0.32	S	S	.	.	H	α-helix	trans	-57.5	-38.9	175.9	-53.2	-47.6	0	0	0	111	A47 L54	A47-D50 WeakPolarHBondContact CB-OD2 3.32Å; A47-D50 PolarHBondContact N-OD2 3.43Å; D50-L54 PolarHBondContact O-N 3.31Å
51	L	86.5	Confident	83.3	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-74.7	-34.1	-179.6	-78.8	163.3	0	0	0	112.6	L42 Q46 A47 E48 E49 L54 M55 V66 C92 F94	L42-L51 HydrophobicContact CD1-CD1 3.65Å; L42-L51 HydrophobicContact CD1-CD2 4.12Å; L42-L51 HydrophobicContact CD2-CD1 4.15Å; L42-L51 HydrophobicContact CD2-CD2 3.34Å; L42-L51 HydrophobicContact CD2-CG 4.27Å; L42-L51 HydrophobicContact CG-CD1 4.48Å; L42-L51 HydrophobicContact CG-CD2 4.37Å; Q46-L51 HydrophobicContact CB-CD1 4.3Å; A47-L51 WeakPolarHBondContact O-CD1 3.4Å; A47-L51 PolarHBondContact O-N 2.79Å; E48-L51 WeakPolarHBondContact O-CB 3.19Å; E48-L51 PolarHBondContact O-N 3.39Å; E49-L51 PolarHBondContact O-N 2.81Å; L51-L54 PolarHBondContact O-N 3.07Å; L51-M55 WeakPolarHBondContact O-CG 3.13Å; L51-M55 PolarHBondContact O-N 3.11Å; L51-V66 HydrophobicContact CD1-CG2 3.92Å; L51-C92 HydrophobicContact CD1-CB 4.29Å; L51-F94 HydrophobicContact CB-CE1 4.42Å; L51-F94 HydrophobicContact CB-CZ 3.94Å; L51-F94 HydrophobicContact CD2-CZ 4.45Å
52	R	87.6	Confident	83.2	Confident	116 Å²	116	68.2 Å²	68.2	44%	0.438	34%	0.336	S	S	.	.	H	α-helix	trans	-66.3	-49.3	173.8	-165.7	178.9	-158.7	165.9	10.1	111.2	E48 E49 L54 M55 E56 V61	E48-R52 WeakPolarHBondContact O-CB 3.47Å; E48-R52 PolarHBondContact O-N 3.44Å; E49-R52 PolarHBondContact O-N 3.29Å; E49-R52 VanDerWaalsContact O-N 3.16Å; R52-L54 PolarHBondContact O-N 3.34Å; R52-M55 PolarHBondContact O-N 3.41Å; R52-E56 WeakPolarHBondContact O-CB 3.47Å; R52-E56 PolarHBondContact O-N 3.5Å; R52-V61 HydrophobicContact CG-CB 4.3Å; R52-V61 HydrophobicContact CG-CG1 4.44Å; R52-V61 HydrophobicContact CG-CG2 4.42Å; R52-V61 PolarHBondContact NH2-O 3.38Å
53	R	87.8	Confident	83.2	Confident	154 Å²	154	71.5 Å²	71.5	58%	0.581	35%	0.351	S	S	*	.	H	α-helix	trans	-58.8	-30.9	176.7	-68.8	174.3	-172.4	-162.3	0.8	113	E49 P57	E49-R53 WeakPolarHBondContact O-CG 3.33Å; E49-R53 PolarHBondContact O-N 3.41Å; E49-R53 IonicContact OE1-CZ 2.71Å; E49-R53 IonicContact OE1-NE 3.21Å; E49-R53 PolarHBondContact OE1-NE 3.37Å; E49-R53 IonicContact OE1-NH2 3.23Å; E49-R53 PolarHBondContact OE1-NH2 3.05Å; R53-P57 WeakPolarHBondContact O-CD 3.08Å
54	L	87	Confident	83.4	Confident	25 Å²	25	71.7 Å²	71.7	13%	0.131	35%	0.353	C	S	.	.	H	α-helix	trans	-73	-34.3	175.4	-176.2	60	0	0	0	113.2	D50 L51 R52 L108 Q112 M114 L121	D50-L54 PolarHBondContact O-N 3.31Å; L51-L54 PolarHBondContact O-N 3.07Å; R52-L54 PolarHBondContact O-N 3.34Å; L54-L108 HydrophobicContact CD1-CD1 4.49Å; L54-L108 HydrophobicContact CD1-CD2 3.71Å; L54-L108 HydrophobicContact CD2-CD1 4.48Å; L54-L108 HydrophobicContact CG-CD1 3.96Å; L54-L108 HydrophobicContact CG-CD2 4.04Å; L54-Q112 VanDerWaalsContact CD2-NE2 3.32Å; L54-M114 HydrophobicContact CD2-SD 4.09Å; L54-L121 HydrophobicContact CD2-CD1 3.38Å
55	M	85.8	Confident	83.8	Confident	5 Å²	5	69 Å²	69	3%	0.025	35%	0.346	C	S	.	.	H	α-helix	trans	-86.6	-25.5	179.7	-63.6	-63.6	141.2	0	0	113.3	V39 L51 R52 P57 H58 G59 V61 F94 A104 L108	V39-M55 HydrophobicContact CG2-CE 3.89Å; L51-M55 WeakPolarHBondContact O-CG 3.13Å; L51-M55 PolarHBondContact O-N 3.11Å; R52-M55 PolarHBondContact O-N 3.41Å; M55-P57 VanDerWaalsContact C-CD 3.45Å; M55-H58 CarbonylContact O-C 3.58Å; M55-H58 WeakPolarHBondContact O-CA 3.46Å; M55-H58 WeakPolarHBondContact O-CB 3.49Å; M55-H58 PolarHBondContact O-N 3.48Å; M55-G59 PolarHBondContact O-N 2.87Å; M55-V61 HydrophobicContact CB-CG2 3.65Å; M55-F94 HydrophobicContact CB-CE1 4.28Å; M55-F94 HydrophobicContact CB-CZ 4.49Å; M55-F94 HydrophobicContact CE-CE2 3.73Å; M55-F94 HydrophobicContact CE-CZ 3.95Å; M55-F94 HydrophobicContact CG-CD1 3.99Å; M55-F94 HydrophobicContact CG-CD2 4.15Å; M55-F94 HydrophobicContact CG-CE1 3.49Å; M55-F94 VanDerWaalsContact CG-CE1 3.49Å; M55-F94 HydrophobicContact CG-CE2 3.68Å; M55-F94 HydrophobicContact CG-CG 4.27Å; M55-F94 HydrophobicContact CG-CZ 3.3Å; M55-F94 HydrophobicContact SD-CD2 4.34Å; M55-F94 HydrophobicContact SD-CE2 3.98Å; M55-F94 HydrophobicContact SD-CZ 4.19Å; M55-A104 HydrophobicContact SD-CB 4.31Å; M55-L108 HydrophobicContact CE-CD1 3.33Å; M55-L108 HydrophobicContact SD-CD1 3.48Å; M55-L108 WeakPolarHBondContact SD-CD1 3.23Å
56	E	87.4	Confident	84.2	Confident	134 Å²	134	62.2 Å²	62.2	63%	0.626	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-51.4	-39.6	-177.1	-179.2	172.9	-159.2	0	0	114.6	R52 H58	R52-E56 WeakPolarHBondContact O-CB 3.47Å; R52-E56 PolarHBondContact O-N 3.5Å; E56-H58 PolarHBondContact O-N 3.3Å
57	P	88.3	Confident	84.1	Confident	99 Å²	99	64.5 Å²	64.5	64%	0.643	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-66.4	-14.5	173.4	-21.8	34.5	0	0	0	115	R53 M55	R53-P57 WeakPolarHBondContact O-CD 3.08Å; M55-P57 VanDerWaalsContact C-CD 3.45Å
58	H	85.4	Confident	83.7	Confident	53 Å²	53	68.5 Å²	68.5	25%	0.245	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-111.9	-6.5	-174.3	-57.6	-65.4	0	0	0	113.7	M55 E56 E100 A104 A107	M55-H58 CarbonylContact O-C 3.58Å; M55-H58 WeakPolarHBondContact O-CA 3.46Å; M55-H58 WeakPolarHBondContact O-CB 3.49Å; M55-H58 PolarHBondContact O-N 3.48Å; E56-H58 PolarHBondContact O-N 3.3Å; H58-E100 WeakPolarHBondContact O-CA 3.46Å; H58-E100 WeakPolarHBondContact O-CB 3.36Å; H58-A104 HydrophobicContact CB-CB 3.79Å; H58-A107 WeakPolarHBondContact CE1-CB 3.45Å
59	G	83.9	Confident	82.8	Confident	14 Å²	14	64.8 Å²	64.8	14%	0.144	32%	0.322	C	S	.	.			trans	159.6	171.7	174.2	0	0	0	0	0	114.9	M55 V61 E100	M55-G59 PolarHBondContact O-N 2.87Å; G59-V61 PolarHBondContact O-N 3.32Å; G59-E100 WeakPolarHBondContact CA-OE1 3.43Å
60	T	83.6	Confident	81.6	Confident	107 Å²	107	66.7 Å²	66.7	66%	0.656	34%	0.342	S	S	*	.			trans	-79.5	113	179.8	-52.4	0	0	0	0	111	E62 E100	T60-E62 PolarHBondContact O-N 3.45Å; T60-E100 PolarHBondContact N-OE1 3.32Å
61	V	83.7	Confident	80.3	Confident	10 Å²	10	69.2 Å²	69.2	6%	0.061	36%	0.356	C	S	.	.			trans	-78.8	105	177	178.5	0	0	0	0	111.1	R52 M55 G59 C64 F94	R52-V61 HydrophobicContact CG-CB 4.3Å; R52-V61 HydrophobicContact CG-CG1 4.44Å; R52-V61 HydrophobicContact CG-CG2 4.42Å; R52-V61 PolarHBondContact NH2-O 3.38Å; M55-V61 HydrophobicContact CB-CG2 3.65Å; G59-V61 PolarHBondContact O-N 3.32Å; V61-C64 HydrophobicContact CG1-CB 4.12Å; V61-F94 HydrophobicContact CG1-CD1 3.78Å; V61-F94 HydrophobicContact CG1-CE1 4.42Å; V61-F94 HydrophobicContact CG2-CD1 4.16Å
62	E	80.8	Confident	78.7	Confident	115 Å²	115	71 Å²	71	54%	0.537	37%	0.374	S	S	.	.	S	Bend	trans	-67.8	-45.5	174.4	-66.1	-179.1	176.3	0	0	111.9	R35 T60 R95	R35-E62 IonicContact NH1-OE1 3.78Å; R35-E62 PolarHBondContact NH1-OE1 2.96Å; R35-E62 IonicContact NH1-OE2 2.64Å; R35-E62 PolarHBondContact NH1-OE2 3.46Å; T60-E62 PolarHBondContact O-N 3.45Å; E62-R95 HydrophobicContact CB-CB 3.86Å; E62-R95 HydrophobicContact CG-CB 4.38Å; E62-R95 PolarHBondContact N-O 3.46Å
63	E	79.5	Confident	76.9	Confident	72 Å²	72	66.9 Å²	66.9	34%	0.336	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	136.5	-175.7	-177.8	-175	-122.8	0	0	107.7	F94 R95	E63-F94 CarbonylContact O-C 3.54Å; E63-F94 VanDerWaalsContact O-CA 3.26Å; E63-F94 WeakPolarHBondContact O-CA 3.32Å; E63-R95 HydrophobicContact CB-CB 4.41Å; E63-R95 HydrophobicContact CB-CG 4.38Å; E63-R95 VanDerWaalsContact CD-NH2 3.32Å; E63-R95 PolarHBondContact O-N 2.88Å; E63-R95 VanDerWaalsContact O-N 3.07Å; E63-R95 IonicContact OE1-NH2 3.05Å; E63-R95 PolarHBondContact OE1-NH2 2.94Å; E63-R95 IonicContact OE2-CZ 2.68Å; E63-R95 IonicContact OE2-NE 2.7Å; E63-R95 PolarHBondContact OE2-NE 3.3Å; E63-R95 IonicContact OE2-NH2 3.55Å; E63-R95 PolarHBondContact OE2-NH2 3.22Å
64	C	82.9	Confident	74.8	Confident	9 Å²	9	60 Å²	60	6%	0.061	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	149.9	165.1	-174.4	0	0	0	0	108.5	E48 V61 I93 F94	E48-C64 HydrophobicContact CG-CB 3.64Å; E48-C64 VanDerWaalsContact CG-SG 3.52Å; V61-C64 HydrophobicContact CG1-CB 4.12Å; C64-I93 CarbonylContact C-O 3.58Å; C64-I93 WeakPolarHBondContact CA-O 3.21Å; C64-F94 HydrophobicContact CB-CD1 3.86Å; C64-F94 HydrophobicContact CB-CE1 3.92Å; C64-F94 WeakPolarHBondContact SG-CE1 3.36Å
65	T	80.7	Confident	72.7	Confident	62 Å²	62	67.3 Å²	67.3	38%	0.38	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	121.5	175.6	-60.3	0	0	0	0	109.5	L67 C92 I93	T65-L67 HydrophobicContact CG2-CD1 4.47Å; T65-L67 WeakPolarHBondContact O-CD1 3.23Å; T65-C92 CarbonylContact O-C 3.58Å; T65-C92 WeakPolarHBondContact O-CA 3.46Å; T65-C92 WeakPolarHBondContact O-CB 3.35Å; T65-I93 PolarHBondContact N-O 3.08Å; T65-I93 PolarHBondContact O-N 2.96Å
66	V	82.5	Confident	70.7	Confident	25 Å²	25	68.7 Å²	68.7	15%	0.152	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	107.1	177.3	-173.2	0	0	0	0	110.6	E48 L51 R68 C92	E48-V66 HydrophobicContact CB-CG2 4.21Å; E48-V66 HydrophobicContact CG-CG2 4.46Å; L51-V66 HydrophobicContact CD1-CG2 3.92Å; V66-R68 HydrophobicContact CG1-CG 4.24Å; V66-R68 PolarHBondContact O-N 3.48Å; V66-C92 HydrophobicContact CG2-CB 4.18Å
67	L	75.2	Confident	68.5	Low	59 Å²	59	71.6 Å²	71.6	31%	0.309	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	112	175.6	-67.4	80.4	0	0	0	110.2	T65 N91 I93	T65-L67 HydrophobicContact CG2-CD1 4.47Å; T65-L67 WeakPolarHBondContact O-CD1 3.23Å; L67-N91 WeakPolarHBondContact CA-O 3.11Å; L67-N91 WeakPolarHBondContact CB-O 3.4Å; L67-N91 PolarHBondContact N-O 3.08Å; L67-N91 PolarHBondContact O-N 2.92Å; L67-I93 HydrophobicContact CD1-CB 4.45Å; L67-I93 HydrophobicContact CD1-CD1 3.91Å; L67-I93 HydrophobicContact CD1-CG1 3.82Å; L67-I93 HydrophobicContact CD2-CD1 4.4Å
68	R	72.5	Confident	66	Low	125 Å²	125	71 Å²	71	47%	0.472	40%	0.396	S	S	.	.			trans	-107.3	152.6	174.4	-59.5	177.6	-173.4	-83.8	-2.7	110	K44 Q46 V66	K44-R68 PolarHBondContact O-NH1 3.44Å; Q46-R68 PolarHBondContact O-NH2 3.28Å; V66-R68 HydrophobicContact CG1-CG 4.24Å; V66-R68 PolarHBondContact O-N 3.48Å
69	G	64.8	Low	63.8	Low	16 Å²	16	77.9 Å²	77.9	17%	0.165	43%	0.425	C	S	.	.			trans	-69.3	158.8	171.5	0	0	0	0	0	111.9	D71 G72 A73	G69-D71 PolarHBondContact O-N 3.09Å; G69-G72 WeakPolarHBondContact O-CA 3.49Å; G69-G72 PolarHBondContact O-N 3.25Å; G69-A73 WeakPolarHBondContact CA-O 3.37Å
70	P	60.6	Low	61.6	Low	133 Å²	133	85 Å²	85	86%	0.864	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.3	176.2	28.5	-35.3	0	0	0	113.2
71	D	59.7	Low	59.3	Low	120 Å²	120	85.4 Å²	85.4	64%	0.642	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	10.8	173.7	55.6	-9.4	0	0	0	112.4	G69 A73	G69-D71 PolarHBondContact O-N 3.09Å; D71-A73 HydrophobicContact CB-CB 4.48Å; D71-A73 PolarHBondContact O-N 3.35Å; D71-A73 WeakPolarHBondContact OD1-CA 3.36Å; D71-A73 VanDerWaalsContact OD1-CB 3.28Å; D71-A73 WeakPolarHBondContact OD1-CB 3.34Å; D71-A73 PolarHBondContact OD1-N 3.45Å; D71-A73 VanDerWaalsContact OD1-O 3.14Å; D71-A73 VanDerWaalsContact OD2-CB 3.27Å; D71-A73 WeakPolarHBondContact OD2-CB 3.48Å
72	G	53.3	Low	56.7	Low	37 Å²	37	90.5 Å²	90.5	38%	0.381	50%	0.496	S	S	.	.	S	Bend	trans	65.9	8.5	-166.2	0	0	0	0	0	113.8	G69	G69-G72 WeakPolarHBondContact O-CA 3.49Å; G69-G72 PolarHBondContact O-N 3.25Å
73	A	48.7	Very low	54.5	Low	30 Å²	30	90.1 Å²	90.1	25%	0.248	51%	0.506	C	S	.	.			trans	-108.6	120.7	-177.5	0	0	0	0	0	112.7	G69 D71 P88	G69-A73 WeakPolarHBondContact CA-O 3.37Å; D71-A73 HydrophobicContact CB-CB 4.48Å; D71-A73 PolarHBondContact O-N 3.35Å; D71-A73 WeakPolarHBondContact OD1-CA 3.36Å; D71-A73 VanDerWaalsContact OD1-CB 3.28Å; D71-A73 WeakPolarHBondContact OD1-CB 3.34Å; D71-A73 PolarHBondContact OD1-N 3.45Å; D71-A73 VanDerWaalsContact OD1-O 3.14Å; D71-A73 VanDerWaalsContact OD2-CB 3.27Å; D71-A73 WeakPolarHBondContact OD2-CB 3.48Å; A73-P88 HydrophobicContact CB-CB 4.45Å; A73-P88 HydrophobicContact CB-CG 3.7Å
74	S	44	Very low	52.5	Low	11 Å²	11	94 Å²	94	8%	0.077	53%	0.529	C	S	.	.			trans	-113.5	142.7	-165	34.8	0	0	0	0	113.1	P88 K89 S90	S74-P88 WeakPolarHBondContact O-CA 3.37Å; S74-P88 WeakPolarHBondContact OG-CA 3.32Å; S74-P88 WeakPolarHBondContact OG-CB 3.34Å; S74-K89 WeakPolarHBondContact CB-O 3.36Å; S74-K89 PolarHBondContact O-N 2.93Å; S74-K89 VanDerWaalsContact O-N 3.08Å; S74-K89 PolarHBondContact OG-N 3.18Å; S74-K89 PolarHBondContact OG-O 2.71Å; S74-S90 WeakPolarHBondContact OG-CA 3.22Å; S74-S90 PolarHBondContact OG-N 2.8Å
75	K	43.4	Very low	50.2	Low	177 Å²	177	103 Å²	103	77%	0.77	57%	0.568	S	S	*	*			trans	-92.3	121.6	-152.5	-60.6	168.3	-178.8	176	0	111.1
76	G	43.5	Very low	48.1	Very low	35 Å²	35	105.6 Å²	105.6	36%	0.361	59%	0.588	S	S	.	*			trans	-163.2	108.2	168.8	0	0	0	0	0	113.9	K89	G76-K89 PolarHBondContact O-NZ 3.39Å
77	K	41.3	Very low	46.2	Very low	194 Å²	194	107.4 Å²	107.4	84%	0.843	61%	0.605	S	S	*	*			trans	-45	134.9	-175	-55.9	178.6	-179.7	-177.2	0	113.8
78	S	36.1	Very low	44.8	Very low	88 Å²	88	105.9 Å²	105.9	62%	0.615	60%	0.599	S	S	*	*			trans	-89.9	146.2	144.8	178.9	0	0	0	0	107.8	H80	S78-H80 PolarHBondContact OG-N 3.28Å; S78-H80 VanDerWaalsContact OG-N 3.14Å; S78-H80 PolarHBondContact OG-O 3.47Å
79	K	39.3	Very low	44	Very low	197 Å²	197	102.1 Å²	102.1	86%	0.857	59%	0.586	S	S	*	*	S	Bend	trans	-85.7	-14.9	170.6	-78	-172.5	174.7	-177.2	0	113
80	H	37.4	Very low	43.9	Very low	163 Å²	163	101.4 Å²	101.4	76%	0.755	58%	0.579	S	S	*	*	S	Bend	trans	-141.6	99.4	-179	-55.1	105.1	0	0	0	108.6	S78	S78-H80 PolarHBondContact OG-N 3.28Å; S78-H80 VanDerWaalsContact OG-N 3.14Å; S78-H80 PolarHBondContact OG-O 3.47Å
81	C	34.6	Very low	44.4	Very low	116 Å²	116	96.3 Å²	96.3	78%	0.784	54%	0.544	S	S	*	.			trans	179.6	97.1	157.3	-102.9	0	0	0	0	108.2
82	S	30.4	Very low	45	Very low	116 Å²	116	90.6 Å²	90.6	81%	0.811	51%	0.514	S	S	*	.			trans	-72.1	143.6	157	-72.8	0	0	0	0	108.7
83	S	35.3	Very low	46.1	Very low	107 Å²	107	90.3 Å²	90.3	75%	0.748	50%	0.503	S	S	*	.	S	Bend	trans	71.2	115.3	-177.8	78.1	0	0	0	0	117
84	N	35.7	Very low	47.5	Very low	153 Å²	153	88.9 Å²	88.9	82%	0.818	49%	0.491	S	S	*	.	S	Bend	trans	65.1	130.7	158	-86	-40.7	0	0	0	122.3
85	K	34.9	Very low	49	Very low	200 Å²	200	91.1 Å²	91.1	87%	0.87	50%	0.498	S	S	*	.			trans	71	75.3	159.3	-61	176.5	-178.8	176.9	0	118	A87	K85-A87 PolarHBondContact O-N 3.42Å
86	S	36.3	Very low	50.6	Low	116 Å²	116	83 Å²	83	81%	0.811	46%	0.463	S	S	*	.			trans	-73.4	115	158.4	54.3	0	0	0	0	111.6
87	A	42.6	Very low	52.4	Low	62 Å²	62	84.8 Å²	84.8	51%	0.512	47%	0.467	S	S	.	.			trans	-74.1	144.7	177.2	0	0	0	0	0	112.8	K85 K89	K85-A87 PolarHBondContact O-N 3.42Å; A87-K89 PolarHBondContact O-N 3.21Å
88	P	47.1	Very low	54.4	Low	27 Å²	27	79.2 Å²	79.2	18%	0.175	44%	0.444	C	S	.	.			trans	-65.3	114.5	178.1	-32.1	44.1	0	0	0	115.3	K44 A73 S74	K44-P88 HydrophobicContact CD-CB 3.97Å; K44-P88 HydrophobicContact CD-CG 4.03Å; K44-P88 VanDerWaalsContact CE-CG 3.42Å; K44-P88 HydrophobicContact CG-CB 3.88Å; K44-P88 HydrophobicContact CG-CG 4.46Å; A73-P88 HydrophobicContact CB-CB 4.45Å; A73-P88 HydrophobicContact CB-CG 3.7Å; S74-P88 WeakPolarHBondContact O-CA 3.37Å; S74-P88 WeakPolarHBondContact OG-CA 3.32Å; S74-P88 WeakPolarHBondContact OG-CB 3.34Å
89	K	54.9	Low	56.8	Low	46 Å²	46	81.5 Å²	81.5	20%	0.2	45%	0.448	C	S	.	.			trans	-97.6	86.9	172.4	-69.5	163.1	176.3	177	0	110.9	M41 S74 G76 A87 N91	M41-K89 HydrophobicContact CE-CD 4.33Å; M41-K89 HydrophobicContact SD-CD 3.56Å; M41-K89 VanDerWaalsContact SD-CD 3.56Å; M41-K89 WeakPolarHBondContact SD-CE 3.13Å; M41-K89 HydrophobicContact SD-CG 3.8Å; S74-K89 WeakPolarHBondContact CB-O 3.36Å; S74-K89 PolarHBondContact O-N 2.93Å; S74-K89 VanDerWaalsContact O-N 3.08Å; S74-K89 PolarHBondContact OG-N 3.18Å; S74-K89 PolarHBondContact OG-O 2.71Å; G76-K89 PolarHBondContact O-NZ 3.39Å; A87-K89 PolarHBondContact O-N 3.21Å; K89-N91 PolarHBondContact O-N 3.13Å; K89-N91 PolarHBondContact O-ND2 3Å; K89-N91 PolarHBondContact O-OD1 3.38Å
90	S	63.1	Low	59.2	Low	2 Å²	2	74.1 Å²	74.1	1%	0.014	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	142.6	174	-70.7	0	0	0	0	108.5	L42 S74	L42-S90 WeakPolarHBondContact CB-O 3.45Å; L42-S90 WeakPolarHBondContact CG-O 3.34Å; L42-S90 PolarHBondContact N-O 3.32Å; L42-S90 PolarHBondContact O-N 2.85Å; L42-S90 VanDerWaalsContact O-N 3.13Å; S74-S90 WeakPolarHBondContact OG-CA 3.22Å; S74-S90 PolarHBondContact OG-N 2.8Å
91	N	71.3	Confident	61.6	Low	25 Å²	25	66.3 Å²	66.3	13%	0.134	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	145	176.4	-45.3	-73.2	0	0	0	108.4	F38 V39 G40 L67 K89	F38-N91 HydrophobicContact CD2-CB 4.31Å; F38-N91 HydrophobicContact CE1-CB 4.09Å; F38-N91 HydrophobicContact CE2-CB 3.48Å; F38-N91 VanDerWaalsContact CE2-CB 3.48Å; F38-N91 HydrophobicContact CZ-CB 3.37Å; F38-N91 WeakPolarHBondContact CZ-OD1 3.5Å; V39-N91 CarbonylContact O-C 3.55Å; V39-N91 WeakPolarHBondContact O-CA 3.46Å; G40-N91 WeakPolarHBondContact CA-OD1 3.33Å; L67-N91 WeakPolarHBondContact CA-O 3.11Å; L67-N91 WeakPolarHBondContact CB-O 3.4Å; L67-N91 PolarHBondContact N-O 3.08Å; L67-N91 PolarHBondContact O-N 2.92Å; K89-N91 PolarHBondContact O-N 3.13Å; K89-N91 PolarHBondContact O-ND2 3Å; K89-N91 PolarHBondContact O-OD1 3.38Å
92	C	73	Confident	64.2	Low	0 Å²	0	65.3 Å²	65.3	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	160.7	169.6	64.6	0	0	0	0	112.2	F38 V39 L42 L51 T65 V66 F94	F38-C92 WeakPolarHBondContact CA-O 3.15Å; V39-C92 PolarHBondContact N-O 3.07Å; V39-C92 PolarHBondContact O-N 2.86Å; L42-C92 HydrophobicContact CD1-CB 4.06Å; L51-C92 HydrophobicContact CD1-CB 4.29Å; T65-C92 CarbonylContact O-C 3.58Å; T65-C92 WeakPolarHBondContact O-CA 3.46Å; T65-C92 WeakPolarHBondContact O-CB 3.35Å; V66-C92 HydrophobicContact CG2-CB 4.18Å; C92-F94 WeakPolarHBondContact SG-CE2 3.29Å; C92-F94 VanDerWaalsContact SG-CZ 3.52Å
93	I	75.4	Confident	67	Low	31 Å²	31	62 Å²	62	16%	0.159	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.7	171.9	-63.2	173.2	0	0	0	108	K36 L37 F38 C64 T65 L67	K36-I93 HydrophobicContact CB-CG2 4.26Å; K36-I93 HydrophobicContact CD-CG2 4.25Å; K36-I93 HydrophobicContact CG-CG2 4.33Å; L37-I93 CarbonylContact O-C 3.55Å; L37-I93 WeakPolarHBondContact O-CA 3.33Å; F38-I93 HydrophobicContact CD2-CG1 4.3Å; C64-I93 CarbonylContact C-O 3.58Å; C64-I93 WeakPolarHBondContact CA-O 3.21Å; T65-I93 PolarHBondContact N-O 3.08Å; T65-I93 PolarHBondContact O-N 2.96Å; L67-I93 HydrophobicContact CD1-CB 4.45Å; L67-I93 HydrophobicContact CD1-CD1 3.91Å; L67-I93 HydrophobicContact CD1-CG1 3.82Å; L67-I93 HydrophobicContact CD2-CD1 4.4Å
94	F	78.8	Confident	69.6	Low	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	157.5	173.1	-59.4	-87	0	0	0	111	K36 L37 V39 L51 M55 V61 E63 C64 C92	K36-F94 VanDerWaalsContact CA-O 3.26Å; K36-F94 WeakPolarHBondContact CA-O 3.47Å; L37-F94 HydrophobicContact CB-CB 4.31Å; L37-F94 HydrophobicContact CB-CD2 4.39Å; L37-F94 PolarHBondContact N-O 3.22Å; L37-F94 PolarHBondContact O-N 3.22Å; V39-F94 HydrophobicContact CB-CE2 4.07Å; V39-F94 HydrophobicContact CG2-CD2 3.89Å; V39-F94 HydrophobicContact CG2-CE2 3.53Å; L51-F94 HydrophobicContact CB-CE1 4.42Å; L51-F94 HydrophobicContact CB-CZ 3.94Å; L51-F94 HydrophobicContact CD2-CZ 4.45Å; M55-F94 HydrophobicContact CB-CE1 4.28Å; M55-F94 HydrophobicContact CB-CZ 4.49Å; M55-F94 HydrophobicContact CE-CE2 3.73Å; M55-F94 HydrophobicContact CE-CZ 3.95Å; M55-F94 HydrophobicContact CG-CD1 3.99Å; M55-F94 HydrophobicContact CG-CD2 4.15Å; M55-F94 HydrophobicContact CG-CE1 3.49Å; M55-F94 VanDerWaalsContact CG-CE1 3.49Å; M55-F94 HydrophobicContact CG-CE2 3.68Å; M55-F94 HydrophobicContact CG-CG 4.27Å; M55-F94 HydrophobicContact CG-CZ 3.3Å; M55-F94 HydrophobicContact SD-CD2 4.34Å; M55-F94 HydrophobicContact SD-CE2 3.98Å; M55-F94 HydrophobicContact SD-CZ 4.19Å; V61-F94 HydrophobicContact CG1-CD1 3.78Å; V61-F94 HydrophobicContact CG1-CE1 4.42Å; V61-F94 HydrophobicContact CG2-CD1 4.16Å; E63-F94 CarbonylContact O-C 3.54Å; E63-F94 VanDerWaalsContact O-CA 3.26Å; E63-F94 WeakPolarHBondContact O-CA 3.32Å; C64-F94 HydrophobicContact CB-CD1 3.86Å; C64-F94 HydrophobicContact CB-CE1 3.92Å; C64-F94 WeakPolarHBondContact SG-CE1 3.36Å; C92-F94 WeakPolarHBondContact SG-CE2 3.29Å; C92-F94 VanDerWaalsContact SG-CZ 3.52Å
95	R	74.3	Confident	72.3	Confident	59 Å²	59	51.4 Å²	51.4	22%	0.223	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	125.8	162.9	-71.9	-174	-149.4	-174.3	14.5	111	R35 K36 E62 E63	R35-R95 VanDerWaalsContact O-CA 3.32Å; R35-R95 WeakPolarHBondContact O-CA 3.45Å; K36-R95 HydrophobicContact CG-CG 4.06Å; E62-R95 HydrophobicContact CB-CB 3.86Å; E62-R95 HydrophobicContact CG-CB 4.38Å; E62-R95 PolarHBondContact N-O 3.46Å; E63-R95 HydrophobicContact CB-CB 4.41Å; E63-R95 HydrophobicContact CB-CG 4.38Å; E63-R95 VanDerWaalsContact CD-NH2 3.32Å; E63-R95 PolarHBondContact O-N 2.88Å; E63-R95 VanDerWaalsContact O-N 3.07Å; E63-R95 IonicContact OE1-NH2 3.05Å; E63-R95 PolarHBondContact OE1-NH2 2.94Å; E63-R95 IonicContact OE2-CZ 2.68Å; E63-R95 IonicContact OE2-NE 2.7Å; E63-R95 PolarHBondContact OE2-NE 3.3Å; E63-R95 IonicContact OE2-NH2 3.55Å; E63-R95 PolarHBondContact OE2-NH2 3.22Å
96	V	78.2	Confident	75	Confident	7 Å²	7	46.1 Å²	46.1	4%	0.042	27%	0.273	C	S	.	.			trans	-148.5	170.7	-178.1	-68.3	0	0	0	0	109.6	R35 L37 E100 A101	R35-V96 WeakPolarHBondContact CA-O 3.43Å; R35-V96 VanDerWaalsContact CB-O 3.29Å; R35-V96 WeakPolarHBondContact CB-O 3.42Å; R35-V96 WeakPolarHBondContact CG-O 3.35Å; R35-V96 PolarHBondContact O-N 3.39Å; L37-V96 HydrophobicContact CD1-CG2 4.02Å; L37-V96 HydrophobicContact CG-CG2 4.03Å; V96-E100 HydrophobicContact CB-CB 4.12Å; V96-A101 HydrophobicContact CG2-CB 3.77Å
97	T	81.5	Confident	77.6	Confident	72 Å²	72	42.4 Å²	42.4	44%	0.442	25%	0.25	S	C	.	.			trans	-73.2	163.9	169.7	68	0	0	0	0	111.8	L99 E100 A101	T97-L99 VanDerWaalsContact C-N 3.33Å; T97-L99 PolarHBondContact O-N 3.02Å; T97-E100 VanDerWaalsContact CB-OE2 3.25Å; T97-E100 WeakPolarHBondContact CB-OE2 3.43Å; T97-E100 VanDerWaalsContact CG2-OE2 3.29Å; T97-E100 WeakPolarHBondContact CG2-OE2 3.41Å; T97-E100 PolarHBondContact N-OE2 3.1Å; T97-E100 PolarHBondContact O-N 3.29Å; T97-E100 VanDerWaalsContact OG1-CD 3.22Å; T97-E100 VanDerWaalsContact OG1-CG 3.27Å; T97-E100 WeakPolarHBondContact OG1-CG 3.46Å; T97-E100 PolarHBondContact OG1-OE2 3.38Å; T97-A101 VanDerWaalsContact O-CB 3.28Å; T97-A101 WeakPolarHBondContact O-CB 3.17Å; T97-A101 PolarHBondContact O-N 3.4Å
98	H	83.1	Confident	80	Confident	77 Å²	77	39.7 Å²	39.7	36%	0.356	23%	0.226	S	C	.	.	H	α-helix	trans	-62.7	-36.3	-177.8	-171.4	89.4	0	0	0	113.3	D34 A101 Q102 F125	D34-H98 WeakPolarHBondContact CB-ND1 3.41Å; D34-H98 IonicContact OD2-ND1 2.63Å; H98-A101 WeakPolarHBondContact O-CB 3.48Å; H98-A101 PolarHBondContact O-N 2.82Å; H98-Q102 PolarHBondContact CD2-NE2 2.99Å; H98-Q102 PolarHBondContact NE2-NE2 3.15Å; H98-Q102 WeakPolarHBondContact O-CG 3.34Å; H98-Q102 PolarHBondContact O-N 3.17Å; H98-F125 AromaticContact CE1-CZ 3.78Å; H98-F125 AromaticContact ND1-CE1 3.94Å
99	L	86.4	Confident	82.1	Confident	135 Å²	135	42.4 Å²	42.4	71%	0.707	24%	0.236	S	C	*	.	H	α-helix	trans	-70.7	-45.3	179.7	-175.6	64.1	0	0	0	111.3	T97 A101 Q102 A103	T97-L99 VanDerWaalsContact C-N 3.33Å; T97-L99 PolarHBondContact O-N 3.02Å; L99-A101 VanDerWaalsContact C-N 3.3Å; L99-A101 PolarHBondContact O-N 3.37Å; L99-Q102 PolarHBondContact O-N 3.32Å; L99-A103 PolarHBondContact O-N 3.41Å
100	E	88.2	Confident	83.8	Confident	42 Å²	42	42.1 Å²	42.1	20%	0.196	25%	0.247	C	C	.	.	H	α-helix	trans	-59.9	-40.4	171.3	-68.2	168.2	133.7	0	0	111.2	H58 G59 T60 V96 T97 Q102 A103 A104	H58-E100 WeakPolarHBondContact O-CA 3.46Å; H58-E100 WeakPolarHBondContact O-CB 3.36Å; G59-E100 WeakPolarHBondContact CA-OE1 3.43Å; T60-E100 PolarHBondContact N-OE1 3.32Å; V96-E100 HydrophobicContact CB-CB 4.12Å; T97-E100 VanDerWaalsContact CB-OE2 3.25Å; T97-E100 WeakPolarHBondContact CB-OE2 3.43Å; T97-E100 VanDerWaalsContact CG2-OE2 3.29Å; T97-E100 WeakPolarHBondContact CG2-OE2 3.41Å; T97-E100 PolarHBondContact N-OE2 3.1Å; T97-E100 PolarHBondContact O-N 3.29Å; T97-E100 VanDerWaalsContact OG1-CD 3.22Å; T97-E100 VanDerWaalsContact OG1-CG 3.27Å; T97-E100 WeakPolarHBondContact OG1-CG 3.46Å; T97-E100 PolarHBondContact OG1-OE2 3.38Å; E100-Q102 PolarHBondContact O-N 3.41Å; E100-A103 PolarHBondContact O-N 2.99Å; E100-A104 VanDerWaalsContact O-CB 3.31Å; E100-A104 WeakPolarHBondContact O-CB 3.27Å; E100-A104 PolarHBondContact O-N 3.19Å
101	A	88	Confident	85	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.6	-46.2	176	0	0	0	0	0	112.1	L37 V96 T97 H98 L99 I105 F125	L37-A101 HydrophobicContact CD1-CB 4.49Å; L37-A101 HydrophobicContact CD2-CB 3.84Å; L37-A101 HydrophobicContact CG-CB 4.14Å; V96-A101 HydrophobicContact CG2-CB 3.77Å; T97-A101 VanDerWaalsContact O-CB 3.28Å; T97-A101 WeakPolarHBondContact O-CB 3.17Å; T97-A101 PolarHBondContact O-N 3.4Å; H98-A101 WeakPolarHBondContact O-CB 3.48Å; H98-A101 PolarHBondContact O-N 2.82Å; L99-A101 VanDerWaalsContact C-N 3.3Å; L99-A101 PolarHBondContact O-N 3.37Å; A101-I105 WeakPolarHBondContact O-CB 3.49Å; A101-I105 WeakPolarHBondContact O-CD1 3.45Å; A101-I105 WeakPolarHBondContact O-CG1 3.48Å; A101-I105 PolarHBondContact O-N 2.75Å; A101-F125 HydrophobicContact CB-CD1 4.44Å; A101-F125 HydrophobicContact CB-CE1 3.59Å; A101-F125 HydrophobicContact CB-CZ 4.09Å
102	Q	89.3	Confident	85.5	Confident	95 Å²	95	47.5 Å²	47.5	44%	0.444	28%	0.279	S	S	.	.	H	α-helix	trans	-63.6	-44.1	176.2	-72.8	-175.1	-7.1	0	0	111.8	H98 L99 E100 I105 A106 F125	H98-Q102 PolarHBondContact CD2-NE2 2.99Å; H98-Q102 PolarHBondContact NE2-NE2 3.15Å; H98-Q102 WeakPolarHBondContact O-CG 3.34Å; H98-Q102 PolarHBondContact O-N 3.17Å; L99-Q102 PolarHBondContact O-N 3.32Å; E100-Q102 PolarHBondContact O-N 3.41Å; Q102-I105 PolarHBondContact O-N 3.19Å; Q102-A106 WeakPolarHBondContact O-CB 3.19Å; Q102-A106 PolarHBondContact O-N 3.2Å; Q102-F125 HydrophobicContact CG-CZ 4.1Å
103	A	89.8	Confident	86.1	Confident	46 Å²	46	51 Å²	51	38%	0.38	30%	0.3	S	S	.	.	H	α-helix	trans	-61.6	-45.6	177.2	0	0	0	0	0	112.1	L99 E100 A106 A107	L99-A103 PolarHBondContact O-N 3.41Å; E100-A103 PolarHBondContact O-N 2.99Å; A103-A106 PolarHBondContact O-N 2.98Å; A103-A107 WeakPolarHBondContact O-CB 3.42Å; A103-A107 PolarHBondContact O-N 2.94Å
104	A	90.6	Very high	86.2	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.033	30%	0.297	C	S	.	.	H	α-helix	trans	-64.1	-42.2	176.3	0	0	0	0	0	112.2	L37 M55 H58 E100 L108	L37-A104 HydrophobicContact CD1-CB 3.83Å; M55-A104 HydrophobicContact SD-CB 4.31Å; H58-A104 HydrophobicContact CB-CB 3.79Å; E100-A104 VanDerWaalsContact O-CB 3.31Å; E100-A104 WeakPolarHBondContact O-CB 3.27Å; E100-A104 PolarHBondContact O-N 3.19Å; A104-L108 WeakPolarHBondContact O-CB 3.36Å; A104-L108 PolarHBondContact O-N 2.76Å
105	I	91.2	Very high	86.2	Confident	34 Å²	34	55.1 Å²	55.1	17%	0.174	33%	0.328	C	S	.	.	H	α-helix	trans	-60.5	-48.3	174.1	-70.1	162.3	0	0	0	110.3	L37 A101 Q102 A107 H109 V123 F125	L37-I105 HydrophobicContact CD2-CD1 3.59Å; L37-I105 HydrophobicContact CD2-CG1 3.67Å; A101-I105 WeakPolarHBondContact O-CB 3.49Å; A101-I105 WeakPolarHBondContact O-CD1 3.45Å; A101-I105 WeakPolarHBondContact O-CG1 3.48Å; A101-I105 PolarHBondContact O-N 2.75Å; Q102-I105 PolarHBondContact O-N 3.19Å; I105-A107 PolarHBondContact O-N 2.78Å; I105-H109 HydrophobicContact CG2-CB 4.45Å; I105-H109 WeakPolarHBondContact O-CB 3.34Å; I105-H109 PolarHBondContact O-N 2.82Å; I105-V123 HydrophobicContact CB-CG1 4.42Å; I105-V123 HydrophobicContact CG1-CG1 3.8Å; I105-F125 HydrophobicContact CD1-CD1 4.45Å; I105-F125 HydrophobicContact CD1-CD2 3.58Å; I105-F125 HydrophobicContact CD1-CE1 4.34Å; I105-F125 HydrophobicContact CD1-CE2 3.44Å; I105-F125 VanDerWaalsContact CD1-CE2 3.44Å; I105-F125 HydrophobicContact CD1-CG 4.1Å; I105-F125 HydrophobicContact CD1-CZ 3.85Å
106	A	91.8	Very high	86.4	Confident	88 Å²	88	55.6 Å²	55.6	73%	0.727	35%	0.351	S	S	*	.	H	α-helix	trans	-64.3	-37.5	-177	0	0	0	0	0	113.1	Q102 A103	Q102-A106 WeakPolarHBondContact O-CB 3.19Å; Q102-A106 PolarHBondContact O-N 3.2Å; A103-A106 PolarHBondContact O-N 2.98Å
107	A	91.9	Very high	86.2	Confident	39 Å²	39	56.1 Å²	56.1	32%	0.322	36%	0.356	S	S	.	.	H	α-helix	trans	-85.5	-32.3	-178.5	0	0	0	0	0	114.2	H58 A103 I105 S111	H58-A107 WeakPolarHBondContact CE1-CB 3.45Å; A103-A107 WeakPolarHBondContact O-CB 3.42Å; A103-A107 PolarHBondContact O-N 2.94Å; I105-A107 PolarHBondContact O-N 2.78Å; A107-S111 WeakPolarHBondContact O-CB 3.4Å; A107-S111 PolarHBondContact O-OG 2.86Å
108	L	91.3	Very high	86	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.026	37%	0.369	C	S	.	.	H	α-helix	trans	-110.9	-14.8	-169	-58.9	178.1	0	0	0	114.5	L54 M55 A104 G110 S111 V123	L54-L108 HydrophobicContact CD1-CD1 4.49Å; L54-L108 HydrophobicContact CD1-CD2 3.71Å; L54-L108 HydrophobicContact CD2-CD1 4.48Å; L54-L108 HydrophobicContact CG-CD1 3.96Å; L54-L108 HydrophobicContact CG-CD2 4.04Å; M55-L108 HydrophobicContact CE-CD1 3.33Å; M55-L108 HydrophobicContact SD-CD1 3.48Å; M55-L108 WeakPolarHBondContact SD-CD1 3.23Å; A104-L108 WeakPolarHBondContact O-CB 3.36Å; A104-L108 PolarHBondContact O-N 2.76Å; L108-G110 PolarHBondContact O-N 3.42Å; L108-S111 WeakPolarHBondContact CA-OG 3.07Å; L108-V123 HydrophobicContact CB-CG2 3.7Å
109	H	91.1	Very high	86	Confident	83 Å²	83	56.2 Å²	56.2	38%	0.384	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	112.2	174	-170.4	15.3	0	0	0	110.6	I105 S111 L121 V123 K124	I105-H109 HydrophobicContact CG2-CB 4.45Å; I105-H109 WeakPolarHBondContact O-CB 3.34Å; I105-H109 PolarHBondContact O-N 2.82Å; H109-S111 PolarHBondContact O-N 2.8Å; H109-L121 PolarHBondContact ND1-O 3.2Å; H109-V123 HydrophobicContact CB-CB 4.24Å; H109-K124 WeakPolarHBondContact NE2-CE 3.47Å
110	G	90.9	Very high	86.1	Confident	40 Å²	40	52 Å²	52	41%	0.412	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	-15.6	175.6	0	0	0	0	0	115.5	L108 S120 L121	L108-G110 PolarHBondContact O-N 3.42Å; G110-S120 VanDerWaalsContact O-CB 3.24Å; G110-S120 WeakPolarHBondContact O-CB 3.23Å; G110-S120 PolarHBondContact O-OG 3.11Å; G110-S120 VanDerWaalsContact O-OG 3.14Å; G110-L121 PolarHBondContact N-O 3.08Å
111	S	88.7	Confident	86.1	Confident	74 Å²	74	50 Å²	50	52%	0.517	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-36.9	-172.3	58.1	0	0	0	0	114.6	A107 L108 H109	A107-S111 WeakPolarHBondContact O-CB 3.4Å; A107-S111 PolarHBondContact O-OG 2.86Å; L108-S111 WeakPolarHBondContact CA-OG 3.07Å; H109-S111 PolarHBondContact O-N 2.8Å
112	Q	82.1	Confident	86.2	Confident	66 Å²	66	51.7 Å²	51.7	31%	0.308	35%	0.351	S	S	.	.			trans	-134.1	146.9	-178.4	64.7	-175.8	63	0	0	113.7	L54 M114 S120 L121	L54-Q112 VanDerWaalsContact CD2-NE2 3.32Å; Q112-M114 PolarHBondContact NE2-SD 3.12Å; Q112-S120 CarbonylContact O-C 3.57Å; Q112-S120 VanDerWaalsContact O-CA 3.24Å; Q112-S120 WeakPolarHBondContact O-CA 3.41Å; Q112-L121 HydrophobicContact CG-CD1 3.75Å; Q112-L121 HydrophobicContact CG-CG 4.3Å; Q112-L121 WeakPolarHBondContact O-CG 3.37Å; Q112-L121 PolarHBondContact O-N 2.76Å
113	T	84.8	Confident	86.2	Confident	73 Å²	73	47.2 Å²	47.2	45%	0.448	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-103.3	120	166.1	-65.9	0	0	0	0	107.9	A117 S120	T113-A117 HydrophobicContact CG2-CB 4Å; T113-A117 VanDerWaalsContact CG2-O 3.29Å; T113-A117 WeakPolarHBondContact CG2-O 3.36Å; T113-S120 VanDerWaalsContact OG1-CA 3.3Å; T113-S120 WeakPolarHBondContact OG1-CA 3.48Å; T113-S120 PolarHBondContact OG1-N 2.98Å; T113-S120 VanDerWaalsContact OG1-N 3.09Å; T113-S120 PolarHBondContact OG1-OG 3.07Å
114	M	78.2	Confident	86.2	Confident	19 Å²	19	50.3 Å²	50.3	9%	0.094	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-68.2	152.8	179.5	-64.2	-59.9	-76.5	0	0	111.6	Q46 L54 Q112 G116 A117 L121	Q46-M114 HydrophobicContact CG-CB 4.19Å; L54-M114 HydrophobicContact CD2-SD 4.09Å; Q112-M114 PolarHBondContact NE2-SD 3.12Å; M114-G116 PolarHBondContact O-N 3.29Å; M114-A117 HydrophobicContact CB-CB 4.3Å; M114-A117 VanDerWaalsContact O-CB 3.23Å; M114-A117 WeakPolarHBondContact O-CB 3.42Å; M114-A117 PolarHBondContact O-N 3.43Å; M114-L121 HydrophobicContact CG-CD1 4.21Å; M114-L121 HydrophobicContact CG-CD2 3.78Å; M114-L121 HydrophobicContact CG-CG 4.21Å; M114-L121 HydrophobicContact SD-CD1 4.3Å
115	P	79.6	Confident	86.1	Confident	100 Å²	100	53.9 Å²	53.9	65%	0.649	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	126.3	173.2	-28.9	36.4	0	0	0	112.8	S43 Q46 A117	S43-P115 WeakPolarHBondContact CB-O 3.36Å; S43-P115 PolarHBondContact OG-O 2.97Å; Q46-P115 PolarHBondContact NE2-O 2.95Å; P115-A117 VanDerWaalsContact C-N 3.28Å; P115-A117 PolarHBondContact O-N 2.88Å
116	G	76.7	Confident	85.8	Confident	69 Å²	69	53.1 Å²	53.1	71%	0.711	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	1.8	-176.2	0	0	0	0	0	115.8	S43 M114	S43-G116 WeakPolarHBondContact CB-O 3.25Å; M114-G116 PolarHBondContact O-N 3.29Å
117	A	75.7	Confident	85.2	Confident	18 Å²	18	52.3 Å²	52.3	15%	0.149	33%	0.332	C	S	.	.			trans	-85	147.9	170.7	0	0	0	0	0	110.5	M41 T113 M114 P115	M41-A117 WeakPolarHBondContact O-CB 3.36Å; T113-A117 HydrophobicContact CG2-CB 4Å; T113-A117 VanDerWaalsContact CG2-O 3.29Å; T113-A117 WeakPolarHBondContact CG2-O 3.36Å; M114-A117 HydrophobicContact CB-CB 4.3Å; M114-A117 VanDerWaalsContact O-CB 3.23Å; M114-A117 WeakPolarHBondContact O-CB 3.42Å; M114-A117 PolarHBondContact O-N 3.43Å; P115-A117 VanDerWaalsContact C-N 3.28Å; P115-A117 PolarHBondContact O-N 2.88Å
118	S	76.9	Confident	84.6	Confident	102 Å²	102	52.9 Å²	52.9	71%	0.713	33%	0.332	S	S	*	.	S	Bend	trans	-94.6	4.2	179.9	63.7	0	0	0	0	113.6
119	S	83.5	Confident	83.7	Confident	49 Å²	49	57 Å²	57	34%	0.343	35%	0.351	S	S	.	.	S	Bend	trans	-162.4	153.9	-173.5	-56.9	0	0	0	0	110.6
120	S	87.4	Confident	82.8	Confident	45 Å²	45	60.6 Å²	60.6	32%	0.315	37%	0.365	S	S	.	.			trans	-62.4	155.4	174.4	-58.7	0	0	0	0	112.8	M41 G110 Q112 T113	M41-S120 WeakPolarHBondContact CB-O 3.33Å; G110-S120 VanDerWaalsContact O-CB 3.24Å; G110-S120 WeakPolarHBondContact O-CB 3.23Å; G110-S120 PolarHBondContact O-OG 3.11Å; G110-S120 VanDerWaalsContact O-OG 3.14Å; Q112-S120 CarbonylContact O-C 3.57Å; Q112-S120 VanDerWaalsContact O-CA 3.24Å; Q112-S120 WeakPolarHBondContact O-CA 3.41Å; T113-S120 VanDerWaalsContact OG1-CA 3.3Å; T113-S120 WeakPolarHBondContact OG1-CA 3.48Å; T113-S120 PolarHBondContact OG1-N 2.98Å; T113-S120 VanDerWaalsContact OG1-N 3.09Å; T113-S120 PolarHBondContact OG1-OG 3.07Å
121	L	88.7	Confident	82.1	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	36%	0.362	C	S	.	.			trans	-58.9	137.9	-178.8	-66.8	-179.7	0	0	0	113.1	V39 L42 L54 H109 G110 Q112 M114 V123	V39-L121 HydrophobicContact CG1-CB 4.49Å; V39-L121 HydrophobicContact CG1-CD2 4.09Å; L42-L121 HydrophobicContact CD2-CD2 3.45Å; L42-L121 VanDerWaalsContact CD2-CD2 3.45Å; L42-L121 HydrophobicContact CG-CD2 4.45Å; L54-L121 HydrophobicContact CD2-CD1 3.38Å; H109-L121 PolarHBondContact ND1-O 3.2Å; G110-L121 PolarHBondContact N-O 3.08Å; Q112-L121 HydrophobicContact CG-CD1 3.75Å; Q112-L121 HydrophobicContact CG-CG 4.3Å; Q112-L121 WeakPolarHBondContact O-CG 3.37Å; Q112-L121 PolarHBondContact O-N 2.76Å; M114-L121 HydrophobicContact CG-CD1 4.21Å; M114-L121 HydrophobicContact CG-CD2 3.78Å; M114-L121 HydrophobicContact CG-CG 4.21Å; M114-L121 HydrophobicContact SD-CD1 4.3Å; L121-V123 HydrophobicContact CB-CG2 4.36Å
122	V	89.4	Confident	81.4	Confident	36 Å²	36	63.3 Å²	63.3	22%	0.218	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	89.2	174.5	178.8	0	0	0	0	108.8	V39 G40 M41 K124	V39-V122 CarbonylContact C-O 3.55Å; V39-V122 VanDerWaalsContact CA-O 3.3Å; V39-V122 WeakPolarHBondContact CA-O 3.48Å; G40-V122 PolarHBondContact N-O 3.43Å; G40-V122 PolarHBondContact O-N 3.4Å; M41-V122 HydrophobicContact CE-CG2 4.15Å; M41-V122 HydrophobicContact CG-CB 4.27Å; M41-V122 HydrophobicContact CG-CG2 3.54Å; V122-K124 HydrophobicContact CG1-CD 4.23Å; V122-K124 HydrophobicContact CG1-CG 4.24Å
123	V	90.5	Very high	81.2	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	122.1	176.4	-172.3	0	0	0	0	108.9	L37 V39 I105 L108 H109 L121	L37-V123 HydrophobicContact CD1-CG1 4.18Å; L37-V123 HydrophobicContact CD2-CG1 4.49Å; V39-V123 HydrophobicContact CB-CG2 4.44Å; V39-V123 HydrophobicContact CG1-CG2 4.02Å; V39-V123 HydrophobicContact CG2-CB 4.15Å; V39-V123 HydrophobicContact CG2-CG1 3.89Å; V39-V123 HydrophobicContact CG2-CG2 3.76Å; I105-V123 HydrophobicContact CB-CG1 4.42Å; I105-V123 HydrophobicContact CG1-CG1 3.8Å; L108-V123 HydrophobicContact CB-CG2 3.7Å; H109-V123 HydrophobicContact CB-CB 4.24Å; L121-V123 HydrophobicContact CB-CG2 4.36Å
124	K	89.7	Confident	80.9	Confident	112 Å²	112	67.3 Å²	67.3	49%	0.487	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	165.9	178.3	-63.8	-167.2	175.3	-166	0	110.1	L37 F38 H109 V122 A126	L37-K124 CarbonylContact C-O 3.54Å; L37-K124 WeakPolarHBondContact CA-O 3Å; L37-K124 WeakPolarHBondContact CD2-O 3.4Å; F38-K124 PolarHBondContact N-O 3.01Å; F38-K124 PolarHBondContact O-N 3.35Å; H109-K124 WeakPolarHBondContact NE2-CE 3.47Å; V122-K124 HydrophobicContact CG1-CD 4.23Å; V122-K124 HydrophobicContact CG1-CG 4.24Å; K124-A126 PolarHBondContact O-N 3.18Å
125	F	89	Confident	80.9	Confident	78 Å²	78	71.3 Å²	71.3	34%	0.342	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	138.4	160.3	-66.6	-77.5	0	0	0	109.7	L37 H98 A101 Q102 I105	L37-F125 HydrophobicContact CD2-CD1 4.4Å; H98-F125 AromaticContact CE1-CZ 3.78Å; H98-F125 AromaticContact ND1-CE1 3.94Å; A101-F125 HydrophobicContact CB-CD1 4.44Å; A101-F125 HydrophobicContact CB-CE1 3.59Å; A101-F125 HydrophobicContact CB-CZ 4.09Å; Q102-F125 HydrophobicContact CG-CZ 4.1Å; I105-F125 HydrophobicContact CD1-CD1 4.45Å; I105-F125 HydrophobicContact CD1-CD2 3.58Å; I105-F125 HydrophobicContact CD1-CE1 4.34Å; I105-F125 HydrophobicContact CD1-CE2 3.44Å; I105-F125 VanDerWaalsContact CD1-CE2 3.44Å; I105-F125 HydrophobicContact CD1-CG 4.1Å; I105-F125 HydrophobicContact CD1-CZ 3.85Å
126	A	84.6	Confident	80.8	Confident	19 Å²	19	73 Å²	73	16%	0.157	38%	0.379	C	S	.	.			trans	-76.6	136.2	176.6	0	0	0	0	0	110	K36 F38 K124 T128	K36-A126 HydrophobicContact CB-CB 3.79Å; K36-A126 PolarHBondContact O-N 3.4Å; F38-A126 HydrophobicContact CB-CB 3.87Å; K124-A126 PolarHBondContact O-N 3.18Å; A126-T128 PolarHBondContact O-N 3.43Å; A126-T128 VanDerWaalsContact O-N 3.16Å
127	D	79.4	Confident	80.7	Confident	71 Å²	71	75.4 Å²	75.4	38%	0.38	37%	0.373	S	S	.	.			trans	-45.1	123.3	170.7	-65	6	0	0	0	109.7	R135	D127-R135 VanDerWaalsContact CG-NH1 3.34Å; D127-R135 IonicContact OD1-CZ 2.91Å; D127-R135 IonicContact OD1-NH1 2.89Å; D127-R135 PolarHBondContact OD1-NH1 2.8Å; D127-R135 IonicContact OD1-NH2 3.91Å; D127-R135 WeakPolarHBondContact OD2-CD 3.19Å; D127-R135 IonicContact OD2-CZ 3.02Å; D127-R135 VanDerWaalsContact OD2-CZ 3.27Å; D127-R135 IonicContact OD2-NE 3.64Å; D127-R135 IonicContact OD2-NH1 3.56Å; D127-R135 PolarHBondContact OD2-NH1 3.29Å
128	T	77.5	Confident	80.8	Confident	50 Å²	50	80.6 Å²	80.6	31%	0.307	40%	0.395	S	S	.	.			trans	-59.7	156.5	174.3	61.7	0	0	0	0	109.9	A126 K130 E131 R132	A126-T128 PolarHBondContact O-N 3.43Å; A126-T128 VanDerWaalsContact O-N 3.16Å; T128-K130 PolarHBondContact O-N 3.38Å; T128-E131 PolarHBondContact O-N 2.63Å; T128-E131 PolarHBondContact OG1-N 2.76Å; T128-E131 VanDerWaalsContact OG1-N 3.13Å; T128-R132 WeakPolarHBondContact O-CB 3.42Å; T128-R132 PolarHBondContact O-N 2.91Å
129	E	72.4	Confident	80.8	Confident	91 Å²	91	82 Å²	82	43%	0.425	39%	0.389	S	S	.	.	H	α-helix	trans	-61.1	-30.8	178.7	-170.8	59.3	-140.6	0	0	111.2	R132 Q133	E129-R132 PolarHBondContact O-N 2.8Å; E129-R132 WeakPolarHBondContact OE2-CD 3.2Å; E129-R132 IonicContact OE2-NH1 3.26Å; E129-Q133 WeakPolarHBondContact O-CB 3.1Å; E129-Q133 WeakPolarHBondContact O-CG 3.31Å; E129-Q133 PolarHBondContact O-N 2.59Å
130	K	73.1	Confident	80.1	Confident	159 Å²	159	86 Å²	86	69%	0.691	41%	0.405	S	S	*	.	H	α-helix	trans	-60.6	-48.7	170	-175.7	-179.7	-179.6	-179.2	0	112.1	T128 Q133 L134	T128-K130 PolarHBondContact O-N 3.38Å; K130-Q133 PolarHBondContact O-N 2.77Å; K130-L134 WeakPolarHBondContact O-CB 3.46Å; K130-L134 PolarHBondContact O-N 2.8Å
131	E	75.4	Confident	79	Confident	75 Å²	75	86.7 Å²	86.7	35%	0.35	41%	0.413	S	S	.	.	H	α-helix	trans	-67.8	-40.1	176.8	-170.8	177.6	174.1	0	0	112	T128 Q133 L134 R135	T128-E131 PolarHBondContact O-N 2.63Å; T128-E131 PolarHBondContact OG1-N 2.76Å; T128-E131 VanDerWaalsContact OG1-N 3.13Å; E131-Q133 VanDerWaalsContact C-N 3.34Å; E131-Q133 PolarHBondContact O-N 3.01Å; E131-L134 PolarHBondContact O-N 2.93Å; E131-R135 HydrophobicContact CG-CG 4.32Å; E131-R135 WeakPolarHBondContact O-CB 3.43Å; E131-R135 VanDerWaalsContact O-CG 3.31Å; E131-R135 WeakPolarHBondContact O-CG 3.21Å; E131-R135 PolarHBondContact O-N 3Å; E131-R135 IonicContact OE1-CZ 3.27Å; E131-R135 IonicContact OE1-NE 3.08Å; E131-R135 PolarHBondContact OE1-NE 3.14Å; E131-R135 IonicContact OE1-NH2 2.76Å; E131-R135 PolarHBondContact OE1-NH2 3.18Å
132	R	75.3	Confident	77.8	Confident	96 Å²	96	91.3 Å²	91.3	36%	0.362	44%	0.441	S	S	.	.	H	α-helix	trans	-59.7	-43.1	173.9	173.1	-177.1	-95.1	-171.4	-4.4	111.7	T128 E129 R136	T128-R132 WeakPolarHBondContact O-CB 3.42Å; T128-R132 PolarHBondContact O-N 2.91Å; E129-R132 PolarHBondContact O-N 2.8Å; E129-R132 WeakPolarHBondContact OE2-CD 3.2Å; E129-R132 IonicContact OE2-NH1 3.26Å; R132-R136 WeakPolarHBondContact O-CB 3.43Å; R132-R136 WeakPolarHBondContact O-CG 3.21Å; R132-R136 PolarHBondContact O-N 2.83Å
133	Q	76.5	Confident	76.3	Confident	113 Å²	113	98.2 Å²	98.2	53%	0.528	47%	0.471	S	S	.	.	H	α-helix	trans	-65.4	-44.6	175.2	-76.2	175.8	16.5	0	0	111.3	E129 K130 E131 R135 R136 M137	E129-Q133 WeakPolarHBondContact O-CB 3.1Å; E129-Q133 WeakPolarHBondContact O-CG 3.31Å; E129-Q133 PolarHBondContact O-N 2.59Å; K130-Q133 PolarHBondContact O-N 2.77Å; E131-Q133 VanDerWaalsContact C-N 3.34Å; E131-Q133 PolarHBondContact O-N 3.01Å; Q133-R135 PolarHBondContact O-N 2.84Å; Q133-R136 WeakPolarHBondContact O-CB 3.2Å; Q133-R136 PolarHBondContact O-N 2.78Å; Q133-M137 WeakPolarHBondContact O-CB 3.31Å; Q133-M137 PolarHBondContact O-N 2.92Å
134	L	80.3	Confident	74.5	Confident	110 Å²	110	105.3 Å²	105.3	58%	0.576	51%	0.506	S	S	*	.	H	α-helix	trans	-61.5	-42.8	176	-174.4	63.2	0	0	0	111.8	K130 E131 M137 Q138	K130-L134 WeakPolarHBondContact O-CB 3.46Å; K130-L134 PolarHBondContact O-N 2.8Å; E131-L134 PolarHBondContact O-N 2.93Å; L134-M137 PolarHBondContact O-N 2.87Å; L134-Q138 VanDerWaalsContact O-CB 3.31Å; L134-Q138 WeakPolarHBondContact O-CB 3.44Å; L134-Q138 PolarHBondContact O-N 3.01Å
135	R	76.5	Confident	72.7	Confident	103 Å²	103	103 Å²	103	39%	0.389	51%	0.514	S	S	.	.	H	α-helix	trans	-65.2	-36.6	174.6	-73.6	175.7	177.3	-158.9	1.2	112.5	D127 E131 Q133 Q139	D127-R135 VanDerWaalsContact CG-NH1 3.34Å; D127-R135 IonicContact OD1-CZ 2.91Å; D127-R135 IonicContact OD1-NH1 2.89Å; D127-R135 PolarHBondContact OD1-NH1 2.8Å; D127-R135 IonicContact OD1-NH2 3.91Å; D127-R135 WeakPolarHBondContact OD2-CD 3.19Å; D127-R135 IonicContact OD2-CZ 3.02Å; D127-R135 VanDerWaalsContact OD2-CZ 3.27Å; D127-R135 IonicContact OD2-NE 3.64Å; D127-R135 IonicContact OD2-NH1 3.56Å; D127-R135 PolarHBondContact OD2-NH1 3.29Å; E131-R135 HydrophobicContact CG-CG 4.32Å; E131-R135 WeakPolarHBondContact O-CB 3.43Å; E131-R135 VanDerWaalsContact O-CG 3.31Å; E131-R135 WeakPolarHBondContact O-CG 3.21Å; E131-R135 PolarHBondContact O-N 3Å; E131-R135 IonicContact OE1-CZ 3.27Å; E131-R135 IonicContact OE1-NE 3.08Å; E131-R135 PolarHBondContact OE1-NE 3.14Å; E131-R135 IonicContact OE1-NH2 2.76Å; E131-R135 PolarHBondContact OE1-NH2 3.18Å; Q133-R135 PolarHBondContact O-N 2.84Å; R135-Q139 WeakPolarHBondContact O-CB 3.28Å; R135-Q139 WeakPolarHBondContact O-CG 3.32Å; R135-Q139 PolarHBondContact O-N 3.36Å
136	R	77.6	Confident	70.7	Confident	137 Å²	137	108.9 Å²	108.9	52%	0.517	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-46.5	171.8	-79.8	173.4	168.9	174.9	-4.6	111.3	R132 Q133 Q138 Q139 M140	R132-R136 WeakPolarHBondContact O-CB 3.43Å; R132-R136 WeakPolarHBondContact O-CG 3.21Å; R132-R136 PolarHBondContact O-N 2.83Å; Q133-R136 WeakPolarHBondContact O-CB 3.2Å; Q133-R136 PolarHBondContact O-N 2.78Å; R136-Q138 PolarHBondContact O-N 3.38Å; R136-Q139 PolarHBondContact O-N 3.38Å; R136-M140 WeakPolarHBondContact O-CG 3.38Å; R136-M140 PolarHBondContact O-N 3.49Å
137	M	75.9	Confident	68.8	Low	118 Å²	118	114.3 Å²	114.3	58%	0.581	57%	0.565	S	S	*	*	H	α-helix	trans	-61.8	-42.8	176.6	-173.4	-174.3	-68	0	0	111.4	Q133 L134 Q139 M140 A141	Q133-M137 WeakPolarHBondContact O-CB 3.31Å; Q133-M137 PolarHBondContact O-N 2.92Å; L134-M137 PolarHBondContact O-N 2.87Å; M137-Q139 VanDerWaalsContact C-N 3.35Å; M137-Q139 PolarHBondContact O-N 3.4Å; M137-M140 PolarHBondContact O-N 3.28Å; M137-A141 WeakPolarHBondContact O-CB 3.41Å; M137-A141 PolarHBondContact O-N 2.79Å
138	Q	78.3	Confident	66.8	Low	128 Å²	128	117.6 Å²	117.6	60%	0.598	58%	0.582	S	S	*	*	H	α-helix	trans	-64.1	-38.7	175.9	-168.8	176.4	47.6	0	0	111.8	L134 R136 A141 T142	L134-Q138 VanDerWaalsContact O-CB 3.31Å; L134-Q138 WeakPolarHBondContact O-CB 3.44Å; L134-Q138 PolarHBondContact O-N 3.01Å; R136-Q138 PolarHBondContact O-N 3.38Å; Q138-A141 PolarHBondContact O-N 2.88Å; Q138-T142 WeakPolarHBondContact O-CB 3.27Å; Q138-T142 PolarHBondContact O-N 3.45Å; Q138-T142 PolarHBondContact O-OG1 3.35Å
139	Q	76.8	Confident	65.1	Low	130 Å²	130	119.9 Å²	119.9	61%	0.607	60%	0.598	S	S	*	*	H	α-helix	trans	-65.2	-38.9	173.6	-75	167.5	28.9	0	0	112.2	R135 R136 M137 Q143	R135-Q139 WeakPolarHBondContact O-CB 3.28Å; R135-Q139 WeakPolarHBondContact O-CG 3.32Å; R135-Q139 PolarHBondContact O-N 3.36Å; R136-Q139 PolarHBondContact O-N 3.38Å; M137-Q139 VanDerWaalsContact C-N 3.35Å; M137-Q139 PolarHBondContact O-N 3.4Å; Q139-Q143 PolarHBondContact O-N 3.24Å
140	M	68.2	Low	63.9	Low	135 Å²	135	122.8 Å²	122.8	67%	0.665	62%	0.616	S	S	*	*	H	α-helix	trans	-66.7	-45.6	173.3	-70.7	174.4	173	0	0	112.1	R136 M137 T142 Q143 M144	R136-M140 WeakPolarHBondContact O-CG 3.38Å; R136-M140 PolarHBondContact O-N 3.49Å; M137-M140 PolarHBondContact O-N 3.28Å; M140-T142 VanDerWaalsContact C-N 3.28Å; M140-T142 PolarHBondContact O-N 3.32Å; M140-Q143 WeakPolarHBondContact O-CB 3.49Å; M140-Q143 PolarHBondContact O-N 2.92Å; M140-M144 PolarHBondContact O-N 2.92Å
141	A	63.9	Low	62.8	Low	59 Å²	59	120.8 Å²	120.8	49%	0.488	62%	0.616	S	S	.	*	H	α-helix	trans	-60.2	-38.4	176.9	0	0	0	0	0	112.1	M137 Q138 Q143 M144	M137-A141 WeakPolarHBondContact O-CB 3.41Å; M137-A141 PolarHBondContact O-N 2.79Å; Q138-A141 PolarHBondContact O-N 2.88Å; A141-Q143 VanDerWaalsContact C-N 3.27Å; A141-Q143 PolarHBondContact O-N 2.9Å; A141-M144 PolarHBondContact O-N 3.47Å
142	T	63.8	Low	61.3	Low	98 Å²	98	124.2 Å²	124.2	60%	0.601	64%	0.636	S	S	*	*	H	α-helix	trans	-66.5	-28.2	175	-48.6	0	0	0	0	112.2	Q138 M140	Q138-T142 WeakPolarHBondContact O-CB 3.27Å; Q138-T142 PolarHBondContact O-N 3.45Å; Q138-T142 PolarHBondContact O-OG1 3.35Å; M140-T142 VanDerWaalsContact C-N 3.28Å; M140-T142 PolarHBondContact O-N 3.32Å
143	Q	56.9	Low	60	Low	181 Å²	181	127 Å²	127	85%	0.846	66%	0.658	S	S	*	*	H	α-helix	trans	-81.3	-23	175.4	-156.1	-168.7	97.5	0	0	112.9	Q139 M140 A141 G145	Q139-Q143 PolarHBondContact O-N 3.24Å; M140-Q143 WeakPolarHBondContact O-CB 3.49Å; M140-Q143 PolarHBondContact O-N 2.92Å; A141-Q143 VanDerWaalsContact C-N 3.27Å; A141-Q143 PolarHBondContact O-N 2.9Å; Q143-G145 VanDerWaalsContact C-N 3.31Å; Q143-G145 PolarHBondContact O-N 3.01Å
144	M	53.2	Low	58.5	Low	149 Å²	149	129.1 Å²	129.1	73%	0.734	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	13.7	-178.2	-96.6	-71.5	-155.5	0	0	115	M140 A141 F146	M140-M144 PolarHBondContact O-N 2.92Å; A141-M144 PolarHBondContact O-N 3.47Å; M144-F146 WeakPolarHBondContact O-CD2 3.38Å; M144-F146 PolarHBondContact O-N 3.41Å
145	G	52.6	Low	57.1	Low	62 Å²	62	129.8 Å²	129.8	64%	0.639	67%	0.671	S	S	*	*			trans	70.8	-6.8	162.5	0	0	0	0	0	118.3	Q143 I147	Q143-G145 VanDerWaalsContact C-N 3.31Å; Q143-G145 PolarHBondContact O-N 3.01Å; G145-I147 VanDerWaalsContact C-N 3.33Å; G145-I147 PolarHBondContact O-N 3.26Å
146	F	46.3	Very low	55.8	Low	202 Å²	202	127.3 Å²	127.3	89%	0.886	68%	0.677	S	S	*	*			trans	-78	77.3	176.9	-82.7	-85.5	0	0	0	112.2	M144	M144-F146 WeakPolarHBondContact O-CD2 3.38Å; M144-F146 PolarHBondContact O-N 3.41Å
147	I	44.6	Very low	54.5	Low	134 Å²	134	125.2 Å²	125.2	69%	0.687	68%	0.68	S	S	*	*			trans	-104.2	111.2	170.5	-55	179.3	0	0	0	109.3	G145 P149	G145-I147 VanDerWaalsContact C-N 3.33Å; G145-I147 PolarHBondContact O-N 3.26Å; I147-P149 HydrophobicContact CG2-CB 4.14Å
148	N	37.7	Very low	53.1	Low	140 Å²	140	129 Å²	129	75%	0.749	69%	0.689	S	S	*	*			trans	-112.9	104.8	157.4	-158	-0.8	0	0	0	107.7	L150	N148-L150 PolarHBondContact O-N 3.45Å
149	P	42.2	Very low	52	Low	97 Å²	97	128.3 Å²	128.3	63%	0.63	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	21.3	-156	32.3	-37.1	0	0	0	115.8	I147	I147-P149 HydrophobicContact CG2-CB 4.14Å
150	L	46.9	Very low	51	Low	153 Å²	153	125 Å²	125	80%	0.801	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.4	-4.3	-173.9	-75.7	172.3	0	0	0	116	N148	N148-L150 PolarHBondContact O-N 3.45Å
151	V	49.3	Very low	50.5	Low	117 Å²	117	120.7 Å²	120.7	71%	0.709	67%	0.67	S	S	*	*	S	Bend	trans	-111.9	24.3	178.7	-159.2	0	0	0	0	112.3
152	L	45.3	Very low	50.1	Low	147 Å²	147	125.7 Å²	125.7	77%	0.77	68%	0.677	S	S	*	*	S	Bend	trans	-101.9	-8.8	-178.1	-159.9	59	0	0	0	114.2
153	N	46.5	Very low	50	Low	154 Å²	154	127.8 Å²	127.8	82%	0.824	68%	0.68	S	S	*	*	S	Bend	trans	-96.3	-0.1	-173.2	-133.7	33	0	0	0	115.3
154	Q	46.6	Very low	50.2	Low	157 Å²	157	125.4 Å²	125.4	73%	0.734	67%	0.669	S	S	*	*	S	Bend	trans	-105.6	-18.3	-174.1	-141.4	172.9	18.4	0	0	114.6
155	I	50.4	Low	50.6	Low	124 Å²	124	123.6 Å²	123.6	64%	0.636	66%	0.662	S	S	*	*	H	α-helix	trans	-86.9	-23.5	-178	-61.5	172.4	0	0	0	112
156	G	49.3	Very low	51.1	Low	51 Å²	51	125.4 Å²	125.4	53%	0.526	66%	0.656	S	S	.	*	H	α-helix	trans	-68	-33.3	176.1	0	0	0	0	0	114	Y158 N159 A160	G156-Y158 VanDerWaalsContact C-N 3.33Å; G156-Y158 PolarHBondContact O-N 3.45Å; G156-N159 PolarHBondContact O-N 3.1Å; G156-A160 PolarHBondContact O-N 3.49Å
157	V	48.8	Very low	52	Low	93 Å²	93	119.1 Å²	119.1	56%	0.564	64%	0.637	S	S	*	*	H	α-helix	trans	-66.3	-35.8	-174.4	-153.7	0	0	0	0	111.9	N159 A160 A161	V157-N159 PolarHBondContact O-N 2.95Å; V157-A160 PolarHBondContact O-N 3.25Å; V157-A161 PolarHBondContact O-N 3.11Å; V157-A161 VanDerWaalsContact O-N 3.08Å
158	Y	47.7	Very low	53	Low	197 Å²	197	119 Å²	119	77%	0.773	63%	0.634	S	S	*	*	H	α-helix	trans	-66.4	-33.7	-178.8	-119.1	-86.7	0	0	0	113.3	G156 Y162	G156-Y158 VanDerWaalsContact C-N 3.33Å; G156-Y158 PolarHBondContact O-N 3.45Å; Y158-Y162 PolarHBondContact O-N 3.02Å
159	N	54.9	Low	54.1	Low	115 Å²	115	118.4 Å²	118.4	62%	0.615	63%	0.626	S	S	*	*	H	α-helix	trans	-78.9	-34.9	177.8	-79.6	-82.1	0	0	0	112.5	G156 V157 Q163	G156-N159 PolarHBondContact O-N 3.1Å; V157-N159 PolarHBondContact O-N 2.95Å; N159-Q163 PolarHBondContact O-N 3.46Å
160	A	56.9	Low	54.9	Low	59 Å²	59	116.7 Å²	116.7	49%	0.488	62%	0.62	S	S	.	*	H	α-helix	trans	-67.1	-44.9	176.5	0	0	0	0	0	111.9	G156 V157 Y162 Q163 Q164	G156-A160 PolarHBondContact O-N 3.49Å; V157-A160 PolarHBondContact O-N 3.25Å; A160-Y162 VanDerWaalsContact C-N 3.33Å; A160-Y162 PolarHBondContact O-N 2.92Å; A160-Q163 PolarHBondContact O-N 2.87Å; A160-Q164 PolarHBondContact O-N 2.86Å
161	A	57.6	Low	55.5	Low	45 Å²	45	111.9 Å²	111.9	37%	0.372	60%	0.602	S	S	.	*	H	α-helix	trans	-62.2	-39.3	177.1	0	0	0	0	0	112.4	V157 Q164 I165	V157-A161 PolarHBondContact O-N 3.11Å; V157-A161 VanDerWaalsContact O-N 3.08Å; A161-Q164 PolarHBondContact O-N 2.99Å; A161-I165 WeakPolarHBondContact O-CG1 3.47Å; A161-I165 PolarHBondContact O-N 3.37Å
162	Y	55.4	Low	55.8	Low	164 Å²	164	111.8 Å²	111.8	64%	0.643	60%	0.597	S	S	*	*	H	α-helix	trans	-67	-41.8	179.1	-151.5	-91	0	0	0	112.4	Y158 A160 L166	Y158-Y162 PolarHBondContact O-N 3.02Å; A160-Y162 VanDerWaalsContact C-N 3.33Å; A160-Y162 PolarHBondContact O-N 2.92Å; Y162-L166 HydrophobicContact CE1-CD1 4.3Å; Y162-L166 PolarHBondContact O-N 2.91Å; Y162-L166 VanDerWaalsContact O-N 3.15Å
163	Q	60.4	Low	56.3	Low	142 Å²	142	110.3 Å²	110.3	66%	0.664	59%	0.589	S	S	*	*	H	α-helix	trans	-61	-44.1	172.2	-80.2	-77.8	-8.6	0	0	111.9	N159 A160 L166 S167	N159-Q163 PolarHBondContact O-N 3.46Å; A160-Q163 PolarHBondContact O-N 2.87Å; Q163-L166 PolarHBondContact O-N 3.33Å; Q163-S167 WeakPolarHBondContact O-CB 3.29Å; Q163-S167 PolarHBondContact O-N 2.75Å; Q163-S167 PolarHBondContact O-OG 3.22Å
164	Q	61.7	Low	56.7	Low	132 Å²	132	105.6 Å²	105.6	62%	0.617	57%	0.572	S	S	*	*	H	α-helix	trans	-65.9	-42	-178.2	-163.5	172.6	-2.6	0	0	112	A160 A161 S167 Q168	A160-Q164 PolarHBondContact O-N 2.86Å; A161-Q164 PolarHBondContact O-N 2.99Å; Q164-S167 PolarHBondContact O-N 2.96Å; Q164-S167 PolarHBondContact O-OG 3.24Å; Q164-Q168 PolarHBondContact O-N 3.28Å; Q164-Q168 VanDerWaalsContact O-N 3.1Å
165	I	60.9	Low	56.9	Low	111 Å²	111	104 Å²	104	57%	0.569	57%	0.568	S	S	*	*	H	α-helix	trans	-64.1	-42.5	176.7	-69.3	167.2	0	0	0	111.7	A161 Q168 Q169	A161-I165 WeakPolarHBondContact O-CG1 3.47Å; A161-I165 PolarHBondContact O-N 3.37Å; I165-Q168 PolarHBondContact O-N 3.35Å; I165-Q169 PolarHBondContact O-N 3Å
166	L	63.5	Low	56.9	Low	100 Å²	100	102.3 Å²	102.3	52%	0.524	56%	0.563	S	S	.	*	H	α-helix	trans	-65.9	-41.8	177.4	-124.6	71.4	0	0	0	112.1	Y162 Q163 Q168 Q169 A170	Y162-L166 HydrophobicContact CE1-CD1 4.3Å; Y162-L166 PolarHBondContact O-N 2.91Å; Y162-L166 VanDerWaalsContact O-N 3.15Å; Q163-L166 PolarHBondContact O-N 3.33Å; L166-Q168 VanDerWaalsContact C-N 3.29Å; L166-Q168 PolarHBondContact O-N 2.93Å; L166-Q169 PolarHBondContact O-N 3.38Å; L166-A170 PolarHBondContact O-N 2.92Å
167	S	64.7	Low	56.9	Low	69 Å²	69	103 Å²	103	48%	0.483	57%	0.565	S	S	.	*	H	α-helix	trans	-63.6	-34.1	178.1	71.4	0	0	0	0	112.8	Q163 Q164 A170 A171	Q163-S167 WeakPolarHBondContact O-CB 3.29Å; Q163-S167 PolarHBondContact O-N 2.75Å; Q163-S167 PolarHBondContact O-OG 3.22Å; Q164-S167 PolarHBondContact O-N 2.96Å; Q164-S167 PolarHBondContact O-OG 3.24Å; S167-A170 PolarHBondContact O-N 3.43Å; S167-A171 PolarHBondContact O-N 3.01Å; S167-A171 VanDerWaalsContact O-N 3.17Å
168	Q	65.6	Low	56.9	Low	133 Å²	133	102.2 Å²	102.2	62%	0.621	57%	0.568	S	S	*	*	H	α-helix	trans	-71.8	-31	178.5	-160.9	171.2	90.1	0	0	112.6	Q164 I165 L166 L172	Q164-Q168 PolarHBondContact O-N 3.28Å; Q164-Q168 VanDerWaalsContact O-N 3.1Å; I165-Q168 PolarHBondContact O-N 3.35Å; L166-Q168 VanDerWaalsContact C-N 3.29Å; L166-Q168 PolarHBondContact O-N 2.93Å; Q168-L172 PolarHBondContact O-N 3.45Å
169	Q	60.8	Low	56.7	Low	127 Å²	127	96.5 Å²	96.5	59%	0.593	56%	0.561	S	S	*	*	H	α-helix	trans	-69.2	-39.3	169.1	-83.6	-174.2	-2.1	0	0	112.7	I165 L166 A171 L172 I173	I165-Q169 PolarHBondContact O-N 3Å; L166-Q169 PolarHBondContact O-N 3.38Å; Q169-A171 VanDerWaalsContact C-N 3.33Å; Q169-A171 PolarHBondContact O-N 2.93Å; Q169-L172 PolarHBondContact O-N 3Å; Q169-I173 PolarHBondContact O-N 3.46Å
170	A	60.3	Low	56.4	Low	60 Å²	60	99.2 Å²	99.2	50%	0.496	57%	0.57	S	S	.	*	H	α-helix	trans	-62.1	-39.2	177.7	0	0	0	0	0	112.5	L166 S167 L172 I173 A174	L166-A170 PolarHBondContact O-N 2.92Å; S167-A170 PolarHBondContact O-N 3.43Å; A170-L172 PolarHBondContact O-N 3.47Å; A170-I173 PolarHBondContact O-N 3.42Å; A170-A174 PolarHBondContact O-N 2.98Å
171	A	58.8	Low	55.9	Low	52 Å²	52	99.9 Å²	99.9	43%	0.43	58%	0.583	S	S	.	*	H	α-helix	trans	-64.4	-36.2	177	0	0	0	0	0	113.3	S167 Q169 A174 N175	S167-A171 PolarHBondContact O-N 3.01Å; S167-A171 VanDerWaalsContact O-N 3.17Å; Q169-A171 VanDerWaalsContact C-N 3.33Å; Q169-A171 PolarHBondContact O-N 2.93Å; A171-A174 PolarHBondContact O-N 2.85Å; A171-N175 PolarHBondContact O-N 3.3Å; A171-N175 VanDerWaalsContact O-N 3.09Å
172	L	56.6	Low	55.2	Low	115 Å²	115	102.2 Å²	102.2	60%	0.602	60%	0.602	S	S	*	*	H	α-helix	trans	-70.4	-32.6	177.5	-74.5	165	0	0	0	112.7	Q168 Q169 A170 T176	Q168-L172 PolarHBondContact O-N 3.45Å; Q169-L172 PolarHBondContact O-N 3Å; A170-L172 PolarHBondContact O-N 3.47Å; L172-T176 PolarHBondContact O-N 3.3Å; L172-T176 PolarHBondContact O-OG1 3.01Å
173	I	55.8	Low	54.5	Low	116 Å²	116	99.1 Å²	99.1	60%	0.595	61%	0.611	S	S	*	*	H	α-helix	trans	-74.8	-37.9	174.3	-61.4	170.4	0	0	0	110.9	Q169 A170 T176 A177	Q169-I173 PolarHBondContact O-N 3.46Å; A170-I173 PolarHBondContact O-N 3.42Å; I173-T176 WeakPolarHBondContact CA-OG1 3.25Å; I173-T176 PolarHBondContact O-N 2.83Å; I173-T176 PolarHBondContact O-OG1 3.37Å; I173-T176 VanDerWaalsContact O-OG1 3.05Å; I173-A177 PolarHBondContact O-N 2.62Å; I173-A177 VanDerWaalsContact O-N 3.07Å
174	A	55	Low	53.3	Low	56 Å²	56	96.4 Å²	96.4	46%	0.463	61%	0.612	S	S	.	*	H	α-helix	trans	-62.9	-43.4	175.4	0	0	0	0	0	112.7	A170 A171 T176 A177 A178	A170-A174 PolarHBondContact O-N 2.98Å; A171-A174 PolarHBondContact O-N 2.85Å; A174-T176 VanDerWaalsContact C-N 3.32Å; A174-T176 PolarHBondContact O-N 3.43Å; A174-A177 PolarHBondContact O-N 2.85Å; A174-A178 WeakPolarHBondContact O-CB 3.13Å; A174-A178 PolarHBondContact O-N 2.8Å
175	N	50.9	Low	52.3	Low	124 Å²	124	100.6 Å²	100.6	66%	0.663	62%	0.624	S	S	*	*	H	α-helix	trans	-68.9	-26.9	178.8	-80.4	5.5	0	0	0	113.6	A171	A171-N175 PolarHBondContact O-N 3.3Å; A171-N175 VanDerWaalsContact O-N 3.09Å
176	T	50.2	Low	51.2	Low	87 Å²	87	103.6 Å²	103.6	53%	0.534	64%	0.64	S	S	.	*	H	α-helix	trans	-80.9	-32.2	175.4	42.1	0	0	0	0	112.4	L172 I173 A174	L172-T176 PolarHBondContact O-N 3.3Å; L172-T176 PolarHBondContact O-OG1 3.01Å; I173-T176 WeakPolarHBondContact CA-OG1 3.25Å; I173-T176 PolarHBondContact O-N 2.83Å; I173-T176 PolarHBondContact O-OG1 3.37Å; I173-T176 VanDerWaalsContact O-OG1 3.05Å; A174-T176 VanDerWaalsContact C-N 3.32Å; A174-T176 PolarHBondContact O-N 3.43Å
177	A	48.6	Very low	49.9	Very low	67 Å²	67	105.1 Å²	105.1	55%	0.554	65%	0.654	S	S	*	*	H	α-helix	trans	-67.6	-40.2	170.1	0	0	0	0	0	112.6	I173 A174 A179 Q180	I173-A177 PolarHBondContact O-N 2.62Å; I173-A177 VanDerWaalsContact O-N 3.07Å; A174-A177 PolarHBondContact O-N 2.85Å; A177-A179 VanDerWaalsContact C-N 3.27Å; A177-A179 PolarHBondContact O-N 3.29Å; A177-Q180 PolarHBondContact O-N 2.64Å
178	A	48.2	Very low	49	Very low	76 Å²	76	107.7 Å²	107.7	63%	0.628	67%	0.669	S	S	*	*	H	α-helix	trans	-63.8	-29.3	179	0	0	0	0	0	113.5	A174 Q180	A174-A178 WeakPolarHBondContact O-CB 3.13Å; A174-A178 PolarHBondContact O-N 2.8Å; A178-Q180 VanDerWaalsContact C-N 3.34Å; A178-Q180 PolarHBondContact O-N 3Å
179	A	44.6	Very low	47.7	Very low	77 Å²	77	107.8 Å²	107.8	64%	0.636	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-74.7	-18.3	-179.9	0	0	0	0	0	114.3	A177	A177-A179 VanDerWaalsContact C-N 3.27Å; A177-A179 PolarHBondContact O-N 3.29Å
180	Q	48.3	Very low	46.7	Very low	172 Å²	172	105.7 Å²	105.7	80%	0.804	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-90.5	-6.6	-177.9	-65.9	-173.5	-5.3	0	0	113.8	A177 A178 A182	A177-Q180 PolarHBondContact O-N 2.64Å; A178-Q180 VanDerWaalsContact C-N 3.34Å; A178-Q180 PolarHBondContact O-N 3Å; Q180-A182 PolarHBondContact O-N 3.21Å
181	G	46.5	Very low	45.6	Very low	73 Å²	73	109.6 Å²	109.6	75%	0.753	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-82.1	-0.2	-178.5	0	0	0	0	0	116.4
182	A	43.3	Very low	44.8	Very low	94 Å²	94	111.6 Å²	111.6	78%	0.777	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-114.4	0.2	-164	0	0	0	0	0	116.3	Q180	Q180-A182 PolarHBondContact O-N 3.21Å
183	A	39.3	Very low	44	Very low	99 Å²	99	112.1 Å²	112.1	82%	0.818	73%	0.727	S	S	*	*			trans	-136.6	64.7	-173.3	0	0	0	0	0	112.8
184	A	36.5	Very low	43.2	Very low	84 Å²	84	110.6 Å²	110.6	69%	0.694	74%	0.74	S	S	*	*			trans	-133.4	48.9	179.3	0	0	0	0	0	112.9
185	Y	40	Very low	42.5	Very low	221 Å²	221	112.9 Å²	112.9	87%	0.867	76%	0.759	S	S	*	*			trans	-139.7	151.5	167.1	-69.4	-76.4	0	0	0	110.6
186	L	38.1	Very low	41.9	Very low	173 Å²	173	112.3 Å²	112.3	91%	0.906	76%	0.76	S	S	*	*			trans	84.9	104	174.3	-46.7	-178.4	0	0	0	117
187	T	36.9	Very low	41.4	Very low	132 Å²	132	117.6 Å²	117.6	81%	0.81	78%	0.776	S	S	*	*			trans	-67.4	162.7	157.6	49.3	0	0	0	0	110.1
188	P	44.4	Very low	40.9	Very low	124 Å²	124	119 Å²	119	81%	0.805	78%	0.781	S	S	*	*				-151.9	163	70	39.1	-17.2	0	0	0	119.7
189	V	38.8	Very low	40.4	Very low	134 Å²	134	123.2 Å²	123.2	81%	0.812	79%	0.793	S	S	*	*			trans	-25.5	136.9	149.4	165.1	0	0	0	0	116.5
190	A	39.6	Very low	40.2	Very low	84 Å²	84	123.8 Å²	123.8	69%	0.694	80%	0.797	S	S	*	*				175	119.4	117.2	0	0	0	0	0	115.7
191	V	36.8	Very low	39.7	Very low	142 Å²	142	120.6 Å²	120.6	86%	0.861	79%	0.792	S	S	*	*			trans	44	126.2	135.3	-168.7	0	0	0	0	121.4
192	A	42.3	Very low	39.8	Very low	94 Å²	94	127.4 Å²	127.4	78%	0.777	80%	0.801	S	S	*	*			trans	-123.7	146.5	154.2	0	0	0	0	0	110.5
193	P	40	Very low	39.8	Very low	125 Å²	125	128.3 Å²	128.3	81%	0.812	80%	0.799	S	S	*	*			trans	-103.7	144.8	-165.3	37.6	-34.4	0	0	0	116.5
194	G	39.6	Very low	39.8	Very low	84 Å²	84	127.8 Å²	127.8	87%	0.866	80%	0.795	S	S	*	*				68.1	104.7	126.9	0	0	0	0	0	121.7
195	A	40.8	Very low	40	Very low	105 Å²	105	129.7 Å²	129.7	87%	0.868	80%	0.798	S	S	*	*			trans	-145.3	148.8	141.2	0	0	0	0	0	109.4
196	T	36.9	Very low	39.9	Very low	111 Å²	111	124.2 Å²	124.2	68%	0.681	79%	0.792	S	S	*	*			trans	-103.1	-173.9	-157.7	45.4	0	0	0	0	115.7
197	F	40.1	Very low	40.2	Very low	198 Å²	198	123.6 Å²	123.6	87%	0.868	79%	0.788	S	S	*	*			trans	85.8	133.6	174.2	-45	-65.5	0	0	0	115.5
198	S	37.7	Very low	40.3	Very low	96 Å²	96	124.8 Å²	124.8	67%	0.671	79%	0.789	S	S	*	*			cis	-162.4	146.4	-15.5	-167.6	0	0	0	0	110
199	L	37.2	Very low	40.4	Very low	165 Å²	165	124.5 Å²	124.5	86%	0.864	79%	0.786	S	S	*	*			trans	24.6	135.4	153.1	-58.6	167.6	0	0	0	119.7
200	A	40.9	Very low	40.7	Very low	89 Å²	89	123.4 Å²	123.4	74%	0.736	79%	0.785	S	S	*	*			cis	-159.1	163.9	24.3	0	0	0	0	0	113.1
201	P	38	Very low	40.8	Very low	106 Å²	106	126.2 Å²	126.2	69%	0.688	79%	0.793	S	S	*	*			trans	-117.4	146	179.1	38.7	-27.6	0	0	0	115.2
202	F	49.7	Very low	41.1	Very low	215 Å²	215	122.8 Å²	122.8	94%	0.943	79%	0.787	S	S	*	*			trans	-151.1	151.3	153.3	-83.2	-68	0	0	0	112
203	P	42.1	Very low	41.2	Very low	113 Å²	113	123.7 Å²	123.7	73%	0.734	79%	0.787	S	S	*	*			trans	-121.1	172.2	-164.9	42.7	-31.6	0	0	0	116.9
204	A	39.9	Very low	41.5	Very low	89 Å²	89	125.5 Å²	125.5	74%	0.736	79%	0.789	S	S	*	*			trans	67.3	136.3	161.7	0	0	0	0	0	117.1
205	T	40.5	Very low	42.1	Very low	123 Å²	123	126.8 Å²	126.8	76%	0.755	78%	0.782	S	S	*	*				-169.9	143.2	53.4	40	0	0	0	0	114.1
206	S	38.8	Very low	42.2	Very low	107 Å²	107	127.4 Å²	127.4	75%	0.748	78%	0.78	S	S	*	*			trans	50	165.3	133.9	-50.4	0	0	0	0	125.6
207	I	42.7	Very low	42.5	Very low	160 Å²	160	127.6 Å²	127.6	82%	0.821	78%	0.783	S	S	*	*			trans	91.9	128.2	162.5	-53.5	160.2	0	0	0	114.4
208	L	40.6	Very low	42.7	Very low	157 Å²	157	123.3 Å²	123.3	82%	0.822	78%	0.777	S	S	*	*			cis	-158.7	160.9	-4.6	-161.8	68	0	0	0	110.2
209	P	46.6	Very low	42.9	Very low	117 Å²	117	124.6 Å²	124.6	76%	0.76	78%	0.781	S	S	*	*			trans	-118.5	166.7	174.7	40.4	-31.6	0	0	0	116.7
210	S	43.8	Very low	43	Very low	111 Å²	111	125.8 Å²	125.8	78%	0.776	78%	0.78	S	S	*	*			trans	-167	153	166.2	54	0	0	0	0	110.6
211	T	42.2	Very low	42.8	Very low	143 Å²	143	127.8 Å²	127.8	88%	0.877	78%	0.783	S	S	*	*			cis	-177	143.3	-32.3	23.1	0	0	0	0	106.6
212	G	43.7	Very low	42.8	Very low	70 Å²	70	126.9 Å²	126.9	72%	0.722	78%	0.784	S	S	*	*			trans	127.6	100.9	168.6	0	0	0	0	0	114.5
213	S	44.4	Very low	42.5	Very low	113 Å²	113	124.4 Å²	124.4	79%	0.79	78%	0.78	S	S	*	*			cis	81.4	143	44.6	92.5	0	0	0	0	113.2
214	I	45.9	Very low	42.4	Very low	164 Å²	164	124.8 Å²	124.8	84%	0.841	78%	0.783	S	S	*	*			cis	-142.3	-175.7	8.4	10.9	176.7	0	0	0	110.6
215	P	51	Low	42.3	Very low	110 Å²	110	127.1 Å²	127.1	71%	0.714	79%	0.787	S	S	*	*			trans	-125.4	-171	-149.7	46.5	-34.8	0	0	0	116.9
216	S	43.3	Very low	42.1	Very low	119 Å²	119	125.1 Å²	125.1	83%	0.832	78%	0.784	S	S	*	*			trans	-172.8	156.9	133	-81.7	0	0	0	0	114.4
217	P	44.3	Very low	42	Very low	114 Å²	114	126.2 Å²	126.2	74%	0.74	79%	0.785	S	S	*	*			trans	-130	-169.9	-161.1	41.9	-24.5	0	0	0	116.8
218	S	43.1	Very low	41.6	Very low	108 Å²	108	125 Å²	125	76%	0.755	79%	0.786	S	S	*	*			trans	88	143	173.9	-28.3	0	0	0	0	114.6
219	T	41.4	Very low	41.2	Very low	123 Å²	123	126.1 Å²	126.1	76%	0.755	79%	0.787	S	S	*	*			cis	-155.8	156.7	21.1	-35.6	0	0	0	0	111.8
220	F	40.2	Very low	40.7	Very low	191 Å²	191	127.3 Å²	127.3	84%	0.838	79%	0.792	S	S	*	*			trans	0.9	142.7	160	-78	-111.3	0	0	0	119.7
221	T	37.7	Very low	40.2	Very low	131 Å²	131	126.4 Å²	126.4	80%	0.804	79%	0.791	S	S	*	*				-165.6	146.8	76.5	-62.2	0	0	0	0	112
222	A	37.7	Very low	40	Very low	86 Å²	86	126.5 Å²	126.5	71%	0.711	79%	0.792	S	S	*	*			trans	-120.4	143.4	174.9	0	0	0	0	0	112
223	L	43.6	Very low	39.6	Very low	163 Å²	163	129.6 Å²	129.6	85%	0.853	80%	0.799	S	S	*	*			trans	-149.7	126.8	165.6	-75.1	180	0	0	0	110.6
224	P	38.2	Very low	39.2	Very low	122 Å²	122	128.2 Å²	128.2	79%	0.792	80%	0.803	S	S	*	*			trans	-139.8	119.8	150	34.1	-18.2	0	0	0	112.5
225	V	38.3	Very low	38.8	Very low	137 Å²	137	124 Å²	124	83%	0.83	80%	0.801	S	S	*	*			trans	-146.9	136.4	178.3	167.6	0	0	0	0	112.5
226	A	37.5	Very low	37.8	Very low	82 Å²	82	126.7 Å²	126.7	68%	0.678	81%	0.809	S	S	*	*			trans	46.4	122.3	158.4	0	0	0	0	0	119.6
227	V	34.9	Very low	37.6	Very low	129 Å²	129	125.7 Å²	125.7	78%	0.782	81%	0.808	S	S	*	*				62.8	106.2	55.5	-174.3	0	0	0	0	114
228	T	35.5	Very low	36.9	Very low	135 Å²	135	127.8 Å²	127.8	83%	0.828	81%	0.812	S	S	*	*			trans	-154.8	129.5	141.6	-65.9	0	0	0	0	108.5
229	Q	33.1	Very low	36.4	Very low	180 Å²	180	133.9 Å²	133.9	84%	0.841	82%	0.82	S	S	*	*			trans	-99.7	140.8	169.4	-61.1	172.1	32	0	0	109
230	T	34.3	Very low	36	Very low	142 Å²	142	132.9 Å²	132.9	87%	0.871	82%	0.818	S	S	*	*			trans	-143.2	124.8	150.5	40.9	0	0	0	0	109.3
231	A	35	Very low	36	Very low	92 Å²	92	131.1 Å²	131.1	76%	0.76	82%	0.817	S	S	*	*			trans	-100.8	150	175	0	0	0	0	0	110.3
232	T	37	Very low	35.9	Very low	145 Å²	145	127.8 Å²	127.8	89%	0.89	81%	0.809	S	S	*	*			trans	-167.4	133.8	146.9	19.5	0	0	0	0	110.4
233	P	35.4	Very low	35.9	Very low	135 Å²	135	131.6 Å²	131.6	88%	0.877	82%	0.816	S	S	*	*			trans	-105.4	165.3	175.5	39.2	-33.1	0	0	0	113.4
234	G	35.7	Very low	35.5	Very low	84 Å²	84	127.2 Å²	127.2	87%	0.866	80%	0.803	S	S	*	*			trans	147	143.7	160.9	0	0	0	0	0	115.1
235	G	37.5	Very low	35	Very low	77 Å²	77	129.6 Å²	129.6	79%	0.794	80%	0.804	S	S	*	*			trans	134	93.8	165.5	0	0	0	0	0	115.9
236	D	31.2	Very low	34.8	Very low	165 Å²	165	133.5 Å²	133.5	88%	0.882	81%	0.805	S	S	*	*			trans	-67.2	158.5	175.1	-54.5	-98.2	0	0	0	115
237	A	38.1	Very low	34.3	Very low	99 Å²	99	134.8 Å²	134.8	82%	0.818	81%	0.809	S	S	*	*				176.4	134.2	115.9	0	0	0	0	0	113.8
238	L	29.2	Very low	34	Very low	158 Å²	158	134.8 Å²	134.8	83%	0.827	81%	0.813	S	S	*	*			trans	-66.5	160.2	164.6	-86.5	66.8	0	0	0	111.8
239	Y	32.8	Very low	33.6	Very low	235 Å²	235	134.4 Å²	134.4	92%	0.922	81%	0.811	S	S	*	*				-158	145.9	121.9	-109.7	-73.4	0	0	0	112
240	S	33.5	Very low	33.6	Very low	102 Å²	102	132.1 Å²	132.1	71%	0.713	81%	0.81	S	S	*	*			trans	-137	148.9	-177.6	-179.7	0	0	0	0	111.2
241	N	41.1	Very low	33.5	Very low	154 Å²	154	131.5 Å²	131.5	82%	0.824	81%	0.806	S	S	*	*			trans	-154.7	129.6	164.5	-88.2	-61.1	0	0	0	105.1
242	G	34.5	Very low	33.5	Very low	62 Å²	62	131.2 Å²	131.2	64%	0.639	80%	0.803	S	S	*	*			cis	90.2	110.3	49.7	0	0	0	0	0	107.8
243	I	36.9	Very low	33.4	Very low	165 Å²	165	130.8 Å²	130.8	85%	0.846	80%	0.801	S	S	*	*				-174.4	147.8	78.1	-88.1	160.2	0	0	0	112.1
244	A	36.7	Very low	33.1	Very low	71 Å²	71	132.6 Å²	132.6	59%	0.587	80%	0.803	S	S	*	*			trans	62.6	131.1	154.9	0	0	0	0	0	123.8
245	Q	27.3	Very low	33.2	Very low	173 Å²	173	131.4 Å²	131.4	81%	0.808	79%	0.791	S	S	*	*			trans	-93.1	157.4	161.6	-55.9	173.9	-66.9	0	0	111
246	Y	33.2	Very low	33.2	Very low	219 Å²	219	137.1 Å²	137.1	86%	0.859	80%	0.797	S	S	*	*			trans	-136.4	139.7	152.7	-48.2	-75.2	0	0	0	109.3
247	S	28.1	Very low	33.4	Very low	109 Å²	109	133.8 Å²	133.8	76%	0.762	79%	0.787	S	S	*	*			trans	-129.9	144.3	179.2	-51.2	0	0	0	0	109.7
248	C	27.6	Very low	33.4	Very low	128 Å²	128	136.5 Å²	136.5	87%	0.865	79%	0.787	S	S	*	*			trans	-148.9	144.3	161.9	60	0	0	0	0	111.2
249	T	27.1	Very low	33.8	Very low	127 Å²	127	133.9 Å²	133.9	78%	0.779	78%	0.778	S	S	*	*			trans	-144.2	133.6	-166.4	-3	0	0	0	0	110.4
250	T	34.4	Very low	34	Very low	133 Å²	133	130.9 Å²	130.9	82%	0.816	77%	0.772	S	S	*	*			trans	-165.5	123.9	169.4	27.9	0	0	0	0	105.6
251	T	30.7	Very low	34.4	Very low	129 Å²	129	132.9 Å²	132.9	79%	0.791	77%	0.774	S	S	*	*			cis	64.7	124	31	-26.9	0	0	0	0	110.9
252	A	35	Very low	34.9	Very low	85 Å²	85	130.7 Å²	130.7	70%	0.702	77%	0.769	S	S	*	*			cis	-137.2	-171.2	3.9	0	0	0	0	0	109.2
253	T	34.9	Very low	35.2	Very low	136 Å²	136	133.4 Å²	133.4	83%	0.834	78%	0.778	S	S	*	*			cis	-167	164.7	49.4	37.6	0	0	0	0	112.8
254	N	29.8	Very low	35.5	Very low	173 Å²	173	130.5 Å²	130.5	93%	0.925	77%	0.772	S	S	*	*			trans	-94.4	170.5	-175.3	-63.5	-50.4	0	0	0	115.6
255	G	38.8	Very low	35.8	Very low	60 Å²	60	131.8 Å²	131.8	62%	0.619	78%	0.777	S	S	*	*			trans	161.4	98.1	164	0	0	0	0	0	109.6
256	E	36.2	Very low	36.3	Very low	196 Å²	196	131.3 Å²	131.3	92%	0.916	78%	0.78	S	S	*	*				64.1	130.1	88.2	-65.9	-175.6	100.6	0	0	112.6
257	S	36.7	Very low	36.5	Very low	96 Å²	96	125.6 Å²	125.6	67%	0.671	78%	0.778	S	S	*	*			cis	-168.2	153.7	24.2	56.5	0	0	0	0	113.7
258	L	37.9	Very low	36.7	Very low	155 Å²	155	126.5 Å²	126.5	81%	0.812	78%	0.779	S	S	*	*			trans	58.9	150.1	145.1	-58.6	163.2	0	0	0	119.9
259	T	36.4	Very low	37.1	Very low	104 Å²	104	129.3 Å²	129.3	64%	0.638	78%	0.777	S	S	*	*			cis	-167.5	151.7	27.3	-20.7	0	0	0	0	113.7
260	Q	37	Very low	37.5	Very low	171 Å²	171	128.1 Å²	128.1	80%	0.799	77%	0.77	S	S	*	*			trans	62.8	150.7	150.7	-83.1	170.3	65.6	0	0	121.9
261	N	42.3	Very low	37.5	Very low	144 Å²	144	125.8 Å²	125.8	77%	0.77	77%	0.772	S	S	*	*			cis	-164.3	180	-21	-130.1	5.2	0	0	0	109.9
262	P	51.7	Low	37.9	Very low	109 Å²	109	123.7 Å²	123.7	71%	0.708	78%	0.776	S	S	*	*			trans	-136.5	-176.6	-138	44.2	-23.2	0	0	0	118.2
263	S	41	Very low	37.9	Very low	119 Å²	119	127.9 Å²	127.9	83%	0.832	79%	0.786	S	S	*	*			trans	-175.6	149.4	151.9	35.9	0	0	0	0	108.8
264	S	42.3	Very low	38.4	Very low	104 Å²	104	127.5 Å²	127.5	73%	0.727	79%	0.786	S	S	*	*			cis	-161.4	153.3	-5.1	47	0	0	0	0	112.1
265	S	43.8	Very low	38.9	Very low	97 Å²	97	123.1 Å²	123.1	68%	0.678	77%	0.773	S	S	*	*			trans	60.8	115.3	152.4	60.8	0	0	0	0	123.3
266	N	37.5	Very low	38.7	Very low	164 Å²	164	130.9 Å²	130.9	88%	0.877	79%	0.786	S	S	*	*				53.1	144.9	124.8	-61.2	2.2	0	0	0	121.2
267	A	38.3	Very low	38.9	Very low	99 Å²	99	126.2 Å²	126.2	82%	0.818	78%	0.781	S	S	*	*			cis	-149.8	163.9	9.5	0	0	0	0	0	113.6
268	T	31.5	Very low	39	Very low	127 Å²	127	128.9 Å²	128.9	78%	0.779	79%	0.793	S	S	*	*			trans	-79.6	144.7	175.8	-51.5	0	0	0	0	113.5
269	F	35.6	Very low	39.3	Very low	187 Å²	187	124.9 Å²	124.9	82%	0.82	79%	0.789	S	S	*	*			trans	169.6	101.1	133.4	-153.9	-100.7	0	0	0	110
270	T	36.3	Very low	39.8	Very low	102 Å²	102	126.5 Å²	126.5	63%	0.626	80%	0.799	S	S	*	*				68.1	90.6	83.4	-43	0	0	0	0	116.6
271	G	34	Very low	39.9	Very low	84 Å²	84	122.9 Å²	122.9	87%	0.866	79%	0.791	S	S	*	*			trans	59	128.8	134.6	0	0	0	0	0	123
272	G	39.5	Very low	39.7	Very low	85 Å²	85	124.7 Å²	124.7	88%	0.876	79%	0.794	S	S	*	*			trans	152.5	106.1	155.4	0	0	0	0	0	116.9
273	L	35	Very low	38.9	Very low	173 Å²	173	127.1 Å²	127.1	91%	0.906	79%	0.794	S	S	*	*			trans	-80.8	152.8	157.6	-76.2	165.3	0	0	0	108.6
274	P	45.6	Very low	38.8	Very low	129 Å²	129	129.7 Å²	129.7	84%	0.838	80%	0.797	S	S	*	*				-149.4	-166	76.7	40.2	-19	0	0	0	115.6
275	A	39.7	Very low	38.6	Very low	80 Å²	80	134.7 Å²	134.7	66%	0.661	80%	0.801	S	S	*	*			trans	-100.5	-176.6	-159.8	0	0	0	0	0	116
276	Y	34.9	Very low	38.4	Very low	224 Å²	224	137.5 Å²	137.5	88%	0.878	81%	0.808	S	S	*	*			trans	65.7	116.7	160.4	83.7	-91.7	0	0	0	119.8
277	A	41	Very low	38.6	Very low	98 Å²	98	137.9 Å²	137.9	81%	0.81	81%	0.805	S	S	*	*				-171.8	148.8	121.3	0	0	0	0	0	111
278	T	38	Very low	38.8	Very low	151 Å²	151	139.4 Å²	139.4	93%	0.926	80%	0.799	S	S	*	*			trans	-88.1	138.1	-175.8	-43.4	0	0	0	0	111.5
279	G	43.9	Very low	39.2	Very low	72 Å²	72	142.1 Å²	142.1	74%	0.742	80%	0.803	S	S	*	*			trans	175.6	127.3	170.7	0	0	0	0	0	113.1
280	T	46.4	Very low	39.7	Very low	138 Å²	138	139.2 Å²	139.2	85%	0.847	80%	0.801	S	S	*	*			trans	-104.8	-175.2	-174.4	66.5	0	0	0	0	110.9
281	P	40	Very low	40.1	Very low	95 Å²	95	140.5 Å²	140.5	62%	0.617	81%	0.809	S	S	*	*				-122.6	165.5	-111.1	31.5	-10.9	0	0	0	114.4
282	Q	37.6	Very low	40.4	Very low	181 Å²	181	146.7 Å²	146.7	85%	0.846	81%	0.808	S	S	*	*			trans	-149.5	151.2	155.2	-84.8	-50.8	-75.3	0	0	111.8
283	F	35.5	Very low	40.9	Very low	161 Å²	161	148 Å²	148	71%	0.706	80%	0.8	S	S	*	*			trans	-96.5	138.2	-175	-62.9	-98.5	0	0	0	112
284	I	39.6	Very low	41.7	Very low	172 Å²	172	143.8 Å²	143.8	88%	0.882	79%	0.791	S	S	*	*			trans	-137	128.6	153.6	-60.7	-176.9	0	0	0	107.2
285	Y	38.1	Very low	42.2	Very low	210 Å²	210	141 Å²	141	82%	0.824	78%	0.779	S	S	*	*			trans	-96.9	136	173.1	-83.7	-96.3	0	0	0	109.9
286	D	39.4	Very low	42.6	Very low	155 Å²	155	147.4 Å²	147.4	83%	0.829	79%	0.787	S	S	*	*			trans	-149.1	160.6	153.2	-165.6	20.7	0	0	0	111.1
287	Q	41.5	Very low	43.5	Very low	172 Å²	172	139.2 Å²	139.2	80%	0.804	77%	0.77	S	S	*	*			trans	-72.2	128.8	-170.4	-58.4	-177.4	0.4	0	0	114
288	N	42.4	Very low	44	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	76%	0.759	S	S	*	*				-161.8	165.7	118.5	-133.6	-44.1	0	0	0	113.2	T290	N288-T290 PolarHBondContact O-N 3.14Å
289	Q	40.2	Very low	44.8	Very low	184 Å²	184	135.5 Å²	135.5	86%	0.86	74%	0.735	S	S	*	*			trans	-49.6	129.4	-177.9	-63	165.2	50.5	0	0	112.9
290	T	44.6	Very low	45.4	Very low	125 Å²	125	138.9 Å²	138.9	77%	0.767	73%	0.729	S	S	*	*			trans	-133.5	121.9	166.6	-51.4	0	0	0	0	110.4	N288 Y292	N288-T290 PolarHBondContact O-N 3.14Å; T290-Y292 PolarHBondContact O-N 3.18Å
291	T	44.5	Very low	46.1	Very low	130 Å²	130	138.5 Å²	138.5	80%	0.798	72%	0.718	S	S	*	*			trans	-62.2	123.1	-179.2	-56.3	0	0	0	0	112.3
292	Y	40.4	Very low	47	Very low	214 Å²	214	140.1 Å²	140.1	84%	0.839	72%	0.717	S	S	*	*			trans	-74.7	128.3	165.8	-66.8	-80.8	0	0	0	110.2	T290 A294	T290-Y292 PolarHBondContact O-N 3.18Å; Y292-A294 PolarHBondContact O-N 2.96Å
293	P	51.5	Low	48.1	Very low	111 Å²	111	135.8 Å²	135.8	72%	0.721	70%	0.703	S	S	*	*			trans	-72.5	113.8	176.9	28	-32.7	0	0	0	110.7	A295	P293-A295 PolarHBondContact O-N 2.86Å
294	A	51.9	Low	49.2	Very low	85 Å²	85	131.4 Å²	131.4	70%	0.702	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	17.8	-179.1	0	0	0	0	0	115.4	Y292	Y292-A294 PolarHBondContact O-N 2.96Å
295	A	55.4	Low	50.1	Low	71 Å²	71	125.8 Å²	125.8	59%	0.587	67%	0.666	S	S	*	*	H	α-helix	trans	-71.4	-31.7	-169.6	0	0	0	0	0	114.1	P293 A299	P293-A295 PolarHBondContact O-N 2.86Å; A295-A299 PolarHBondContact O-N 3.16Å
296	Y	48.2	Very low	50.9	Low	215 Å²	215	118.6 Å²	118.6	84%	0.843	65%	0.649	S	S	*	*	H	α-helix	trans	-73.8	-29.1	-174.1	-151.5	-96.7	0	0	0	113.4
297	G	53.5	Low	51.6	Low	51 Å²	51	118 Å²	118	53%	0.526	64%	0.642	S	S	.	*	H	α-helix	trans	-73.3	-37.3	175.7	0	0	0	0	0	113.3	A299 F300 Q301	G297-A299 VanDerWaalsContact C-N 3.35Å; G297-A299 PolarHBondContact O-N 2.77Å; G297-F300 PolarHBondContact O-N 3.03Å; G297-Q301 PolarHBondContact O-N 2.81Å
298	Q	51.8	Low	52.2	Low	121 Å²	121	115.8 Å²	115.8	57%	0.565	63%	0.631	S	S	*	*	H	α-helix	trans	-63.4	-39.7	179.1	-72.5	-71.5	-45.2	0	0	112.1	F300 Q301 Q302	Q298-F300 PolarHBondContact O-N 3.49Å; Q298-Q301 PolarHBondContact O-N 2.73Å; Q298-Q302 WeakPolarHBondContact O-CB 3.32Å; Q298-Q302 WeakPolarHBondContact O-CG 3.33Å; Q298-Q302 PolarHBondContact O-N 3.17Å
299	A	55.4	Low	52.6	Low	51 Å²	51	112 Å²	112	42%	0.421	62%	0.618	S	S	.	*	H	α-helix	trans	-58.8	-48.9	177.7	0	0	0	0	0	111.9	A295 G297 Q301 Q302 V303	A295-A299 PolarHBondContact O-N 3.16Å; G297-A299 VanDerWaalsContact C-N 3.35Å; G297-A299 PolarHBondContact O-N 2.77Å; A299-Q301 PolarHBondContact O-N 3.05Å; A299-Q302 WeakPolarHBondContact O-CB 3.49Å; A299-Q302 PolarHBondContact O-N 3.29Å; A299-Q302 VanDerWaalsContact O-N 3.16Å; A299-V303 WeakPolarHBondContact O-CG2 3.47Å; A299-V303 PolarHBondContact O-N 2.84Å
300	F	56.3	Low	53	Low	143 Å²	143	106.2 Å²	106.2	63%	0.627	60%	0.602	S	S	*	*	H	α-helix	trans	-64.9	-39.6	-179.4	-165.5	-104.7	0	0	0	112.4	G297 Q298 Q302 V303 I304	G297-F300 PolarHBondContact O-N 3.03Å; Q298-F300 PolarHBondContact O-N 3.49Å; F300-Q302 VanDerWaalsContact C-N 3.3Å; F300-Q302 PolarHBondContact O-N 2.96Å; F300-V303 PolarHBondContact O-N 3.2Å; F300-I304 HydrophobicContact CD1-CD1 3.98Å; F300-I304 HydrophobicContact CE1-CD1 3.63Å; F300-I304 HydrophobicContact CZ-CD1 4.29Å; F300-I304 PolarHBondContact O-N 3.02Å
301	Q	60	Low	53.3	Low	129 Å²	129	105.9 Å²	105.9	60%	0.603	60%	0.595	S	S	*	*	H	α-helix	trans	-62	-39	173.9	-149.6	78.9	47.2	0	0	111.6	G297 Q298 A299 I304 A305	G297-Q301 PolarHBondContact O-N 2.81Å; Q298-Q301 PolarHBondContact O-N 2.73Å; A299-Q301 PolarHBondContact O-N 3.05Å; Q301-I304 PolarHBondContact O-N 3.02Å; Q301-A305 WeakPolarHBondContact O-CB 3.24Å; Q301-A305 PolarHBondContact O-N 2.91Å
302	Q	59.2	Low	53.5	Low	129 Å²	129	105.4 Å²	105.4	60%	0.603	58%	0.582	S	S	*	*	H	α-helix	trans	-68.7	-34	175.6	-78.8	178.3	-25	0	0	113.2	Q298 A299 F300 A306	Q298-Q302 WeakPolarHBondContact O-CB 3.32Å; Q298-Q302 WeakPolarHBondContact O-CG 3.33Å; Q298-Q302 PolarHBondContact O-N 3.17Å; A299-Q302 WeakPolarHBondContact O-CB 3.49Å; A299-Q302 PolarHBondContact O-N 3.29Å; A299-Q302 VanDerWaalsContact O-N 3.16Å; F300-Q302 VanDerWaalsContact C-N 3.3Å; F300-Q302 PolarHBondContact O-N 2.96Å; Q302-A306 WeakPolarHBondContact O-CB 3.35Å; Q302-A306 PolarHBondContact O-N 2.99Å
303	V	60	Low	53.7	Low	90 Å²	90	103.7 Å²	103.7	55%	0.545	58%	0.582	S	S	.	*	H	α-helix	trans	-66	-43.2	174.3	-166.8	0	0	0	0	111	A299 F300 A306 Q307	A299-V303 WeakPolarHBondContact O-CG2 3.47Å; A299-V303 PolarHBondContact O-N 2.84Å; F300-V303 PolarHBondContact O-N 3.2Å; V303-A306 PolarHBondContact O-N 2.89Å; V303-Q307 WeakPolarHBondContact O-CB 3.48Å; V303-Q307 PolarHBondContact O-N 3.28Å
304	I	59.2	Low	53.3	Low	69 Å²	69	102.9 Å²	102.9	35%	0.354	57%	0.568	S	S	.	*	H	α-helix	trans	-65.2	-44.6	177.1	-65	173.4	0	0	0	110.9	F300 Q301 Q307 Q308	F300-I304 HydrophobicContact CD1-CD1 3.98Å; F300-I304 HydrophobicContact CE1-CD1 3.63Å; F300-I304 HydrophobicContact CZ-CD1 4.29Å; F300-I304 PolarHBondContact O-N 3.02Å; Q301-I304 PolarHBondContact O-N 3.02Å; I304-Q307 PolarHBondContact O-N 2.69Å; I304-Q308 PolarHBondContact O-N 3.14Å
305	A	58.7	Low	53.2	Low	55 Å²	55	104 Å²	104	46%	0.455	57%	0.571	S	S	.	*	H	α-helix	trans	-64.3	-39.5	176.8	0	0	0	0	0	112.3	Q301 Q308 A309	Q301-A305 WeakPolarHBondContact O-CB 3.24Å; Q301-A305 PolarHBondContact O-N 2.91Å; A305-Q308 PolarHBondContact O-N 3.5Å; A305-A309 WeakPolarHBondContact O-CB 3.29Å; A305-A309 PolarHBondContact O-N 2.81Å
306	A	54.6	Low	53.5	Low	58 Å²	58	105.6 Å²	105.6	48%	0.479	57%	0.566	S	S	.	*	H	α-helix	trans	-67.4	-37	175	0	0	0	0	0	112	Q302 V303 A309 A310	Q302-A306 WeakPolarHBondContact O-CB 3.35Å; Q302-A306 PolarHBondContact O-N 2.99Å; V303-A306 PolarHBondContact O-N 2.89Å; A306-A309 PolarHBondContact O-N 3.17Å; A306-A310 WeakPolarHBondContact O-CB 3.26Å; A306-A310 PolarHBondContact O-N 3.38Å
307	Q	54.5	Low	54.6	Low	143 Å²	143	101.3 Å²	101.3	67%	0.668	55%	0.552	S	S	*	*	H	α-helix	trans	-71.4	-31.4	177.3	-165.5	155.1	43.9	0	0	112.4	V303 I304	V303-Q307 WeakPolarHBondContact O-CB 3.48Å; V303-Q307 PolarHBondContact O-N 3.28Å; I304-Q307 PolarHBondContact O-N 2.69Å
308	Q	53.8	Low	56.1	Low	125 Å²	125	103.3 Å²	103.3	58%	0.584	55%	0.548	S	S	*	.	H	α-helix	trans	-71.3	-42.9	167.2	-72.8	179.2	-2.5	0	0	111.8	I304 A305 A310 L311 F312	I304-Q308 PolarHBondContact O-N 3.14Å; A305-Q308 PolarHBondContact O-N 3.5Å; Q308-A310 VanDerWaalsContact C-N 3.27Å; Q308-A310 PolarHBondContact O-N 2.89Å; Q308-L311 WeakPolarHBondContact O-CB 3.49Å; Q308-L311 PolarHBondContact O-N 3.46Å; Q308-L311 VanDerWaalsContact O-N 3.11Å; Q308-F312 WeakPolarHBondContact O-CD2 3.34Å
309	A	51.6	Low	57.5	Low	52 Å²	52	98.1 Å²	98.1	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-62.2	-31.8	176.3	0	0	0	0	0	113.2	A305 A306 L311 F312 Q313	A305-A309 WeakPolarHBondContact O-CB 3.29Å; A305-A309 PolarHBondContact O-N 2.81Å; A306-A309 PolarHBondContact O-N 3.17Å; A309-L311 PolarHBondContact O-N 2.8Å; A309-F312 PolarHBondContact O-N 3.33Å; A309-Q313 PolarHBondContact O-N 3.27Å
310	A	49	Very low	59	Low	64 Å²	64	98.6 Å²	98.6	53%	0.529	53%	0.526	S	S	.	.	H	α-helix	trans	-65.8	-22.4	175.4	0	0	0	0	0	113.8	A306 Q308	A306-A310 WeakPolarHBondContact O-CB 3.26Å; A306-A310 PolarHBondContact O-N 3.38Å; Q308-A310 VanDerWaalsContact C-N 3.27Å; Q308-A310 PolarHBondContact O-N 2.89Å
311	L	49.6	Very low	60.3	Low	118 Å²	118	98.2 Å²	98.2	62%	0.618	53%	0.53	S	S	*	.	H	α-helix	trans	-75.3	-34.9	169.4	-71.7	166.5	0	0	0	111.7	Q308 A309	Q308-L311 WeakPolarHBondContact O-CB 3.49Å; Q308-L311 PolarHBondContact O-N 3.46Å; Q308-L311 VanDerWaalsContact O-N 3.11Å; A309-L311 PolarHBondContact O-N 2.8Å
312	F	49.9	Very low	61.7	Low	119 Å²	119	93.2 Å²	93.2	52%	0.522	51%	0.514	S	S	.	.	H	α-helix	trans	-79.7	-16.1	-176	-82	-84.8	0	0	0	115	Q308 A309 A337 M340	Q308-F312 WeakPolarHBondContact O-CD2 3.34Å; A309-F312 PolarHBondContact O-N 3.33Å; F312-A337 HydrophobicContact CZ-CB 4.32Å; F312-M340 HydrophobicContact CE2-CE 4.35Å; F312-M340 HydrophobicContact CZ-CE 3.88Å
313	Q	42.6	Very low	63.4	Low	178 Å²	178	87.2 Å²	87.2	83%	0.832	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	15.7	175.5	-68.7	-163.9	-0.3	0	0	114.7	A309 S315	A309-Q313 PolarHBondContact O-N 3.27Å; Q313-S315 PolarHBondContact O-N 2.7Å
314	Q	43.1	Very low	65	Low	95 Å²	95	83.2 Å²	83.2	44%	0.444	46%	0.461	S	S	.	.			trans	-72.5	115	174	-65.4	-163.8	13	0	0	111.4	Q316	Q314-Q316 PolarHBondContact O-N 2.93Å
315	S	50.3	Low	66.8	Low	109 Å²	109	80 Å²	80	76%	0.762	45%	0.445	S	S	*	.			trans	-41.3	121.6	160.3	51.8	0	0	0	0	109.6	Q313 K317	Q313-S315 PolarHBondContact O-N 2.7Å; S315-K317 PolarHBondContact O-N 3.45Å
316	Q	61.5	Low	68.6	Low	104 Å²	104	79.7 Å²	79.7	49%	0.486	43%	0.433	S	S	.	.			trans	-34.1	90.2	-167	-68.9	-178.2	-60.9	0	0	113.6	Q314 E318	Q314-Q316 PolarHBondContact O-N 2.93Å; Q316-E318 PolarHBondContact O-N 3.26Å
317	K	71.8	Confident	70.6	Confident	124 Å²	124	76.9 Å²	76.9	54%	0.539	41%	0.41	S	S	.	.			trans	-82.6	104.5	-178.9	-169	176	179.4	-179.6	0	106.9	S315 I350 S351	S315-K317 PolarHBondContact O-N 3.45Å; K317-I350 HydrophobicContact CB-CG2 3.82Å; K317-I350 HydrophobicContact CD-CG2 3.97Å; K317-I350 HydrophobicContact CG-CG2 3.76Å; K317-I350 WeakPolarHBondContact O-CG2 3.44Å; K317-S351 PolarHBondContact O-OG 3.42Å
318	E	84.3	Confident	72.7	Confident	93 Å²	93	73.9 Å²	73.9	44%	0.435	39%	0.393	S	S	.	.			trans	-83	129.3	172.8	-57.6	-168.5	154.4	0	0	108.5	Q316 F368 K399	Q316-E318 PolarHBondContact O-N 3.26Å; E318-F368 HydrophobicContact CG-CE1 4.22Å; E318-F368 HydrophobicContact CG-CZ 4.01Å; E318-K399 IonicContact OE1-NZ 2.78Å; E318-K399 PolarHBondContact OE1-NZ 2.84Å; E318-K399 IonicContact OE2-NZ 2.77Å; E318-K399 PolarHBondContact OE2-NZ 2.81Å
319	G	82.2	Confident	74.6	Confident	12 Å²	12	72.5 Å²	72.5	12%	0.124	39%	0.387	C	S	.	.			trans	-69.1	-178.7	163.8	0	0	0	0	0	112.2	N324 S370	G319-N324 PolarHBondContact O-ND2 3.01Å; G319-S370 PolarHBondContact N-OG 3.46Å
320	P	86.1	Confident	76.7	Confident	62 Å²	62	70 Å²	70	40%	0.403	37%	0.366	S	S	.	.	S	Bend	trans	-58.1	158.1	-171.6	-15.1	23.3	0	0	0	113.3	G322 C323 N324 D372	P320-G322 PolarHBondContact O-N 3.13Å; P320-C323 VanDerWaalsContact O-CB 3.23Å; P320-C323 WeakPolarHBondContact O-CB 3.32Å; P320-C323 PolarHBondContact O-N 3.18Å; P320-C323 PolarHBondContact O-SG 3.09Å; P320-C323 VanDerWaalsContact O-SG 3.32Å; P320-N324 PolarHBondContact O-ND2 3Å; P320-D372 WeakPolarHBondContact CD-O 3.36Å
321	D	85.3	Confident	78.8	Confident	134 Å²	134	67.5 Å²	67.5	72%	0.717	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	135.1	169.5	-81.2	-60	0	0	0	111	C323	D321-C323 VanDerWaalsContact C-N 3.35Å
322	G	88.6	Confident	80.8	Confident	25 Å²	25	67 Å²	67	26%	0.258	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	-1.2	-172	0	0	0	0	0	115.9	P320 L398	P320-G322 PolarHBondContact O-N 3.13Å; G322-L398 WeakPolarHBondContact O-CD1 3.33Å
323	C	94	Very high	82.8	Confident	3 Å²	3	68.3 Å²	68.3	2%	0.02	35%	0.347	C	S	.	.	S	Bend	trans	-106.7	0.7	176.7	-43.9	0	0	0	0	113.1	P320 D321 F371 S374	P320-C323 VanDerWaalsContact O-CB 3.23Å; P320-C323 WeakPolarHBondContact O-CB 3.32Å; P320-C323 PolarHBondContact O-N 3.18Å; P320-C323 PolarHBondContact O-SG 3.09Å; P320-C323 VanDerWaalsContact O-SG 3.32Å; D321-C323 VanDerWaalsContact C-N 3.35Å; C323-F371 HydrophobicContact CB-CB 4.41Å; C323-F371 WeakPolarHBondContact CB-O 3.42Å; C323-F371 PolarHBondContact O-N 2.88Å; C323-S374 PolarHBondContact SG-N 2.9Å
324	N	95.1	Very high	85.1	Confident	6 Å²	6	61.5 Å²	61.5	3%	0.032	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	129.1	-169.2	-70.7	-54.1	0	0	0	111.1	G319 P320 F368 S370 K399	G319-N324 PolarHBondContact O-ND2 3.01Å; P320-N324 PolarHBondContact O-ND2 3Å; N324-F368 HydrophobicContact CB-CE2 3.91Å; N324-F368 HydrophobicContact CB-CZ 4.05Å; N324-F368 WeakPolarHBondContact OD1-CZ 3.14Å; N324-S370 WeakPolarHBondContact OD1-CB 3.05Å; N324-S370 PolarHBondContact OD1-OG 3.02Å; N324-K399 HydrophobicContact CB-CB 3.76Å; N324-K399 HydrophobicContact CB-CD 4.11Å; N324-K399 HydrophobicContact CB-CG 4.4Å; N324-K399 WeakPolarHBondContact O-CB 3.46Å; N324-K399 PolarHBondContact O-N 3.35Å
325	L	96.7	Very high	87.5	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	144.4	-173.9	-57	-174.2	0	0	0	112.8	I327 F343 F368 V369 F371 A377 A380 I381 V396 Q397 L398	L325-I327 HydrophobicContact CB-CD1 4.02Å; L325-F343 HydrophobicContact CD1-CD1 4.36Å; L325-F343 HydrophobicContact CD1-CE1 4.06Å; L325-F368 WeakPolarHBondContact O-CA 3.32Å; L325-F368 WeakPolarHBondContact O-CD2 3.2Å; L325-V369 PolarHBondContact N-O 3.25Å; L325-V369 PolarHBondContact O-N 3.02Å; L325-F371 HydrophobicContact CD1-CD2 4.22Å; L325-F371 HydrophobicContact CD1-CE2 3.75Å; L325-A377 HydrophobicContact CD2-CB 4.15Å; L325-A377 HydrophobicContact CG-CB 4.37Å; L325-A380 HydrophobicContact CD1-CB 3.93Å; L325-I381 HydrophobicContact CD1-CG1 4.36Å; L325-I381 HydrophobicContact CD2-CD1 3.56Å; L325-I381 HydrophobicContact CD2-CG1 3.65Å; L325-V396 HydrophobicContact CB-CG1 4.45Å; L325-V396 HydrophobicContact CD1-CG1 3.9Å; L325-Q397 CarbonylContact C-O 3.57Å; L325-Q397 WeakPolarHBondContact CA-O 3.31Å; L325-L398 HydrophobicContact CD2-CD1 4.06Å
326	F	96.7	Very high	89.6	Confident	49 Å²	49	55.4 Å²	55.4	22%	0.215	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	133	161	-77.5	-67.5	0	0	0	110.6	Y328 G367 F368 V396 Q397 K399	F326-Y328 HydrophobicContact CB-CD2 4.37Å; F326-Y328 HydrophobicContact CB-CE2 3.52Å; F326-Y328 HydrophobicContact CG-CE2 4.47Å; F326-G367 WeakPolarHBondContact CA-O 3.23Å; F326-F368 HydrophobicContact CD1-CD2 4.36Å; F326-F368 HydrophobicContact CE1-CB 4.48Å; F326-F368 HydrophobicContact CE1-CD2 4.18Å; F326-V396 WeakPolarHBondContact O-CA 3.44Å; F326-Q397 PolarHBondContact N-O 2.85Å; F326-Q397 PolarHBondContact O-N 2.9Å; F326-K399 HydrophobicContact CD2-CB 4.07Å; F326-K399 HydrophobicContact CD2-CG 4.41Å; F326-K399 HydrophobicContact CE2-CB 3.98Å; F326-K399 HydrophobicContact CE2-CD 4.16Å; F326-K399 HydrophobicContact CE2-CG 3.81Å; F326-K399 HydrophobicContact CZ-CD 4.42Å
327	I	96.7	Very high	91.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	124.2	179.5	-56.5	72.9	0	0	0	107.4	L325 L330 L339 F343 F366 G367 V369 L394 V396	L325-I327 HydrophobicContact CB-CD1 4.02Å; I327-L330 HydrophobicContact CG2-CD2 3.66Å; I327-L330 HydrophobicContact CG2-CG 4.03Å; I327-L339 HydrophobicContact CB-CD1 4.41Å; I327-L339 HydrophobicContact CD1-CD1 4.44Å; I327-L339 HydrophobicContact CG1-CD1 4.2Å; I327-F343 HydrophobicContact CD1-CE1 4.45Å; I327-F343 HydrophobicContact CD1-CZ 4.19Å; I327-F343 HydrophobicContact CG1-CE1 4.12Å; I327-F343 HydrophobicContact CG1-CE2 3.87Å; I327-F343 HydrophobicContact CG1-CZ 3.45Å; I327-F343 VanDerWaalsContact CG1-CZ 3.45Å; I327-F343 HydrophobicContact CG2-CZ 4.45Å; I327-F366 CarbonylContact O-C 3.53Å; I327-F366 WeakPolarHBondContact O-CA 3.48Å; I327-F366 WeakPolarHBondContact O-CB 3.21Å; I327-G367 PolarHBondContact N-O 3.41Å; I327-G367 PolarHBondContact O-N 3.2Å; I327-V369 HydrophobicContact CD1-CB 3.83Å; I327-V369 HydrophobicContact CD1-CG2 3.6Å; I327-L394 HydrophobicContact CG2-CD2 4.39Å; I327-V396 HydrophobicContact CG1-CG1 4.41Å; I327-V396 HydrophobicContact CG1-CG2 4.37Å; I327-V396 HydrophobicContact CG2-CG2 4.36Å
328	Y	97.1	Very high	92.2	Very high	80 Å²	80	50.6 Å²	50.6	31%	0.314	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	160.7	178.7	-55.4	-95.8	0	0	0	111.3	F326 L330 F366 L394 K395	F326-Y328 HydrophobicContact CB-CD2 4.37Å; F326-Y328 HydrophobicContact CB-CE2 3.52Å; F326-Y328 HydrophobicContact CG-CE2 4.47Å; Y328-L330 VanDerWaalsContact C-N 3.29Å; Y328-F366 HydrophobicContact CD1-CB 3.76Å; Y328-F366 HydrophobicContact CD1-CG 4.43Å; Y328-F366 HydrophobicContact CE1-CB 4.28Å; Y328-F366 HydrophobicContact CG-CB 4.38Å; Y328-L394 WeakPolarHBondContact O-CA 3.31Å; Y328-K395 PolarHBondContact N-O 3.31Å; Y328-K395 PolarHBondContact O-N 3.1Å
329	H	95.5	Very high	92.7	Very high	96 Å²	96	46.2 Å²	46.2	44%	0.444	25%	0.247	S	C	.	.	S	Bend	trans	65.3	29.5	-176.3	-43.4	149.9	0	0	0	113.8	C365 K392 R393	H329-C365 PolarHBondContact N-O 3.05Å; H329-K392 HydrophobicContact CB-CB 4.28Å; H329-K392 HydrophobicContact CB-CD 4.34Å; H329-R393 WeakPolarHBondContact CB-O 3.36Å; H329-R393 PolarHBondContact ND1-O 3.21Å
330	L	95	Very high	93.3	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.255	C	S	.	.			trans	-56.2	148.9	167.5	-66.9	173.9	0	0	0	109.8	I327 Y328 F334 L339 V354 C365 L394	I327-L330 HydrophobicContact CG2-CD2 3.66Å; I327-L330 HydrophobicContact CG2-CG 4.03Å; Y328-L330 VanDerWaalsContact C-N 3.29Å; L330-F334 HydrophobicContact CB-CB 4.44Å; L330-F334 HydrophobicContact CD2-CD1 4.19Å; L330-L339 HydrophobicContact CD1-CD1 4.23Å; L330-L339 HydrophobicContact CD1-CD2 4.44Å; L330-L339 HydrophobicContact CD2-CD1 4.12Å; L330-V354 HydrophobicContact CD1-CG2 3.99Å; L330-C365 PolarHBondContact N-O 3.47Å; L330-C365 VanDerWaalsContact O-CB 3.29Å; L330-C365 WeakPolarHBondContact O-CB 3.12Å; L330-L394 HydrophobicContact CD2-CD2 3.91Å
331	P	92.6	Very high	93.7	Very high	10 Å²	10	51.9 Å²	51.9	7%	0.065	27%	0.265	C	S	.	.			trans	-59.6	161.6	164.2	-18.9	32.4	0	0	0	111.2	E333 F334 I389	P331-E333 VanDerWaalsContact C-N 3.32Å; P331-E333 HydrophobicContact CB-CG 4.02Å; P331-E333 WeakPolarHBondContact CB-OE1 3.42Å; P331-E333 WeakPolarHBondContact CB-OE2 3.47Å; P331-F334 HydrophobicContact CB-CD2 3.77Å; P331-F334 HydrophobicContact CB-CE2 4.36Å; P331-F334 HydrophobicContact CG-CD2 3.57Å; P331-F334 HydrophobicContact CG-CE2 3.78Å; P331-F334 HydrophobicContact CG-CG 4.27Å; P331-F334 PolarHBondContact O-N 2.98Å; P331-I389 HydrophobicContact CG-CB 4.49Å; P331-I389 HydrophobicContact CG-CD1 3.6Å; P331-I389 HydrophobicContact CG-CG1 3.73Å; P331-I389 HydrophobicContact CG-CG2 3.99Å
332	Q	91.8	Very high	94.2	Very high	107 Å²	107	47.4 Å²	47.4	50%	0.5	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-28.2	-176.7	-175.7	176.2	-28.8	0	0	111.4	F334 Q362 S363	Q332-F334 VanDerWaalsContact C-N 3.3Å; Q332-Q362 VanDerWaalsContact NE2-CD 3.28Å; Q332-S363 WeakPolarHBondContact O-CB 3.33Å
333	E	91.1	Very high	94.5	Very high	148 Å²	148	46.2 Å²	46.2	69%	0.692	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-5.5	175.9	65.4	-87.2	-151.9	0	0	114.3	P331	P331-E333 VanDerWaalsContact C-N 3.32Å; P331-E333 HydrophobicContact CB-CG 4.02Å; P331-E333 WeakPolarHBondContact CB-OE1 3.42Å; P331-E333 WeakPolarHBondContact CB-OE2 3.47Å
334	F	92.2	Very high	94.6	Very high	35 Å²	35	50.7 Å²	50.7	15%	0.154	25%	0.25	C	S	.	.			trans	-82.6	123.4	176.4	-95.3	-121.6	0	0	0	111.5	L330 P331 Q332 E338 M342 I389	L330-F334 HydrophobicContact CB-CB 4.44Å; L330-F334 HydrophobicContact CD2-CD1 4.19Å; P331-F334 HydrophobicContact CB-CD2 3.77Å; P331-F334 HydrophobicContact CB-CE2 4.36Å; P331-F334 HydrophobicContact CG-CD2 3.57Å; P331-F334 HydrophobicContact CG-CE2 3.78Å; P331-F334 HydrophobicContact CG-CG 4.27Å; P331-F334 PolarHBondContact O-N 2.98Å; Q332-F334 VanDerWaalsContact C-N 3.3Å; F334-E338 HydrophobicContact CD1-CB 3.86Å; F334-E338 HydrophobicContact CE1-CB 4.03Å; F334-E338 HydrophobicContact CG-CB 4.23Å; F334-M342 HydrophobicContact CE1-CE 3.45Å; F334-M342 VanDerWaalsContact CE1-CE 3.45Å; F334-M342 HydrophobicContact CE1-SD 3.93Å; F334-M342 HydrophobicContact CZ-CE 3.59Å; F334-I389 HydrophobicContact CE1-CD1 4.3Å; F334-I389 HydrophobicContact CE2-CD1 3.63Å; F334-I389 HydrophobicContact CZ-CD1 3.47Å; F334-I389 VanDerWaalsContact CZ-CD1 3.47Å
335	G	93	Very high	94.7	Very high	21 Å²	21	55.4 Å²	55.4	22%	0.216	28%	0.281	C	S	.	.			trans	-105.5	-171.1	170.2	0	0	0	0	0	113.3	A337 E338 L339 V354	G335-A337 VanDerWaalsContact C-N 3.29Å; G335-A337 PolarHBondContact O-N 3.22Å; G335-E338 VanDerWaalsContact C-OE2 3.25Å; G335-E338 WeakPolarHBondContact CA-OE2 3.46Å; G335-E338 PolarHBondContact N-OE2 3.14Å; G335-L339 WeakPolarHBondContact O-CB 3.24Å; G335-L339 PolarHBondContact O-N 3.07Å; G335-L339 VanDerWaalsContact O-N 3.08Å; G335-V354 VanDerWaalsContact C-CG2 3.46Å; G335-V354 VanDerWaalsContact O-CG2 3.32Å; G335-V354 WeakPolarHBondContact O-CG2 3.43Å
336	D	94	Very high	94.6	Very high	55 Å²	55	57.8 Å²	57.8	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-62.6	-36.6	-177	-64.1	-6.2	0	0	0	112	M340 K353 V354	D336-M340 WeakPolarHBondContact O-CB 3.33Å; D336-M340 PolarHBondContact O-N 2.68Å; D336-K353 WeakPolarHBondContact OD1-CA 3.21Å; D336-V354 PolarHBondContact OD1-N 3.46Å
337	A	93.6	Very high	94.5	Very high	40 Å²	40	56.5 Å²	56.5	33%	0.331	29%	0.293	S	S	.	.	H	α-helix	trans	-70.9	-45.6	-178.7	0	0	0	0	0	112.1	F312 G335 M340 Q341	F312-A337 HydrophobicContact CZ-CB 4.32Å; G335-A337 VanDerWaalsContact C-N 3.29Å; G335-A337 PolarHBondContact O-N 3.22Å; A337-M340 PolarHBondContact O-N 3.02Å; A337-Q341 WeakPolarHBondContact O-CB 3.21Å; A337-Q341 PolarHBondContact O-N 3.24Å
338	E	94.1	Very high	94.4	Very high	87 Å²	87	62.5 Å²	62.5	41%	0.407	32%	0.32	S	S	.	.	H	α-helix	trans	-65.5	-41	177.7	-61.5	70.1	-152.1	0	0	110.6	F334 G335 Q341 M342	F334-E338 HydrophobicContact CD1-CB 3.86Å; F334-E338 HydrophobicContact CE1-CB 4.03Å; F334-E338 HydrophobicContact CG-CB 4.23Å; G335-E338 VanDerWaalsContact C-OE2 3.25Å; G335-E338 WeakPolarHBondContact CA-OE2 3.46Å; G335-E338 PolarHBondContact N-OE2 3.14Å; E338-Q341 PolarHBondContact O-N 2.94Å; E338-M342 WeakPolarHBondContact O-CB 3.3Å; E338-M342 PolarHBondContact O-N 3.23Å
339	L	95.5	Very high	94.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-43	174.7	-179.5	63.8	0	0	0	111.6	I327 L330 G335 F343 A352 V354 V369	I327-L339 HydrophobicContact CB-CD1 4.41Å; I327-L339 HydrophobicContact CD1-CD1 4.44Å; I327-L339 HydrophobicContact CG1-CD1 4.2Å; L330-L339 HydrophobicContact CD1-CD1 4.23Å; L330-L339 HydrophobicContact CD1-CD2 4.44Å; L330-L339 HydrophobicContact CD2-CD1 4.12Å; G335-L339 WeakPolarHBondContact O-CB 3.24Å; G335-L339 PolarHBondContact O-N 3.07Å; G335-L339 VanDerWaalsContact O-N 3.08Å; L339-F343 HydrophobicContact CD1-CD2 4Å; L339-F343 HydrophobicContact CD1-CE2 3.89Å; L339-F343 WeakPolarHBondContact O-CD2 3.49Å; L339-F343 PolarHBondContact O-N 3.5Å; L339-A352 HydrophobicContact CD2-CB 4.5Å; L339-A352 HydrophobicContact CG-CB 4.41Å; L339-V354 HydrophobicContact CB-CG2 4.02Å; L339-V354 HydrophobicContact CD2-CG2 3.81Å; L339-V369 HydrophobicContact CD1-CG2 3.88Å; L339-V369 HydrophobicContact CD2-CG2 3.93Å; L339-V369 HydrophobicContact CG-CG2 3.67Å
340	M	95.1	Very high	94.2	Very high	59 Å²	59	57.1 Å²	57.1	29%	0.291	30%	0.3	S	S	.	.	H	α-helix	trans	-60.9	-54.8	174.6	-172.5	169.5	64.6	0	0	110.5	F312 D336 A337 M342 F343 M344 V349 A352	F312-M340 HydrophobicContact CE2-CE 4.35Å; F312-M340 HydrophobicContact CZ-CE 3.88Å; D336-M340 WeakPolarHBondContact O-CB 3.33Å; D336-M340 PolarHBondContact O-N 2.68Å; A337-M340 PolarHBondContact O-N 3.02Å; M340-M342 VanDerWaalsContact C-N 3.29Å; M340-M342 PolarHBondContact O-N 3.26Å; M340-F343 PolarHBondContact O-N 3Å; M340-M344 HydrophobicContact CG-CG 4.21Å; M340-M344 VanDerWaalsContact O-CG 3.27Å; M340-M344 WeakPolarHBondContact O-CG 3.46Å; M340-M344 PolarHBondContact O-N 3.03Å; M340-V349 HydrophobicContact CG-CB 4.43Å; M340-V349 HydrophobicContact CG-CG1 4.19Å; M340-A352 HydrophobicContact CB-CB 3.74Å; M340-A352 HydrophobicContact CG-CB 4.29Å
341	Q	95.1	Very high	94.1	Very high	134 Å²	134	58.1 Å²	58.1	63%	0.626	31%	0.307	S	S	*	.	H	α-helix	trans	-60.2	-36.9	-175.4	-172.3	174.1	13.6	0	0	112.7	A337 E338 F343 M344 P345	A337-Q341 WeakPolarHBondContact O-CB 3.21Å; A337-Q341 PolarHBondContact O-N 3.24Å; E338-Q341 PolarHBondContact O-N 2.94Å; Q341-F343 VanDerWaalsContact C-N 3.27Å; Q341-F343 PolarHBondContact O-N 2.94Å; Q341-M344 HydrophobicContact CG-CE 4.32Å; Q341-P345 WeakPolarHBondContact O-CD 3.3Å
342	M	94.2	Very high	94.3	Very high	41 Å²	41	58.7 Å²	58.7	20%	0.202	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-29.3	174.3	175.8	174.1	-82.7	0	0	113.2	F334 E338 M340 M384 I389 L394	F334-M342 HydrophobicContact CE1-CE 3.45Å; F334-M342 VanDerWaalsContact CE1-CE 3.45Å; F334-M342 HydrophobicContact CE1-SD 3.93Å; F334-M342 HydrophobicContact CZ-CE 3.59Å; E338-M342 WeakPolarHBondContact O-CB 3.3Å; E338-M342 PolarHBondContact O-N 3.23Å; M340-M342 VanDerWaalsContact C-N 3.29Å; M340-M342 PolarHBondContact O-N 3.26Å; M342-M384 HydrophobicContact CE-CE 4.21Å; M342-M384 HydrophobicContact CG-CE 3.54Å; M342-M384 HydrophobicContact SD-CE 3.46Å; M342-M384 WeakPolarHBondContact SD-CE 3.1Å; M342-I389 HydrophobicContact CE-CD1 4.03Å; M342-L394 HydrophobicContact SD-CD1 3.93Å
343	F	96.2	Very high	94.4	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-102.6	-17.5	-175.3	-82.3	-101.9	0	0	0	114.6	L325 I327 L339 M340 Q341 P345 F346 V349 V369 F371 A380 M384 V396	L325-F343 HydrophobicContact CD1-CD1 4.36Å; L325-F343 HydrophobicContact CD1-CE1 4.06Å; I327-F343 HydrophobicContact CD1-CE1 4.45Å; I327-F343 HydrophobicContact CD1-CZ 4.19Å; I327-F343 HydrophobicContact CG1-CE1 4.12Å; I327-F343 HydrophobicContact CG1-CE2 3.87Å; I327-F343 HydrophobicContact CG1-CZ 3.45Å; I327-F343 VanDerWaalsContact CG1-CZ 3.45Å; I327-F343 HydrophobicContact CG2-CZ 4.45Å; L339-F343 HydrophobicContact CD1-CD2 4Å; L339-F343 HydrophobicContact CD1-CE2 3.89Å; L339-F343 WeakPolarHBondContact O-CD2 3.49Å; L339-F343 PolarHBondContact O-N 3.5Å; M340-F343 PolarHBondContact O-N 3Å; Q341-F343 VanDerWaalsContact C-N 3.27Å; Q341-F343 PolarHBondContact O-N 2.94Å; F343-P345 VanDerWaalsContact C-N 3.32Å; F343-F346 HydrophobicContact CD1-CD2 4.37Å; F343-F346 WeakPolarHBondContact O-CD2 3.43Å; F343-F346 PolarHBondContact O-N 3.38Å; F343-V349 HydrophobicContact CB-CG2 4.2Å; F343-V369 HydrophobicContact CB-CG1 3.98Å; F343-V369 HydrophobicContact CB-CG2 4.39Å; F343-V369 HydrophobicContact CD1-CB 4.49Å; F343-V369 HydrophobicContact CD1-CG1 4.2Å; F343-V369 HydrophobicContact CD1-CG2 4.43Å; F343-V369 HydrophobicContact CD2-CG2 4.2Å; F343-V369 HydrophobicContact CG-CG1 4.18Å; F343-V369 HydrophobicContact CG-CG2 4.08Å; F343-F371 HydrophobicContact CB-CZ 4.02Å; F343-F371 HydrophobicContact CD1-CE2 4.09Å; F343-F371 HydrophobicContact CD1-CZ 4.01Å; F343-A380 HydrophobicContact CD1-CB 3.86Å; F343-A380 HydrophobicContact CE1-CB 3.98Å; F343-M384 HydrophobicContact CE1-CB 4.39Å; F343-M384 HydrophobicContact CE1-CG 4.29Å; F343-M384 HydrophobicContact CZ-CB 4.08Å; F343-M384 HydrophobicContact CZ-CG 4.15Å; F343-V396 HydrophobicContact CE1-CG1 4.26Å; F343-V396 HydrophobicContact CZ-CG1 4.47Å; F343-V396 HydrophobicContact CZ-CG2 4.12Å
344	M	95.5	Very high	94.7	Very high	97 Å²	97	50.9 Å²	50.9	48%	0.478	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-51.9	-36.7	174.5	-61.3	-162.5	-53	0	0	115.2	M340 Q341 F346 G347 V349	M340-M344 HydrophobicContact CG-CG 4.21Å; M340-M344 VanDerWaalsContact O-CG 3.27Å; M340-M344 WeakPolarHBondContact O-CG 3.46Å; M340-M344 PolarHBondContact O-N 3.03Å; Q341-M344 HydrophobicContact CG-CE 4.32Å; M344-F346 PolarHBondContact O-N 3.23Å; M344-F346 VanDerWaalsContact O-N 3.07Å; M344-G347 PolarHBondContact O-N 3.05Å; M344-G347 VanDerWaalsContact O-N 3.11Å; M344-G347 VanDerWaalsContact O-O 3.04Å; M344-V349 HydrophobicContact CG-CG2 4.46Å
345	P	96.4	Very high	94.8	Very high	104 Å²	104	52.2 Å²	52.2	68%	0.675	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-62.2	-17.2	-178.9	-25.9	36.5	0	0	0	114.9	Q341 F343	Q341-P345 WeakPolarHBondContact O-CD 3.3Å; F343-P345 VanDerWaalsContact C-N 3.32Å
346	F	95.9	Very high	94.8	Very high	50 Å²	50	55.7 Å²	55.7	22%	0.219	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-91.9	-12.8	179.3	-50.7	-65.6	0	0	0	113.3	F343 M344 F371 S376 A380 A383 M384	F343-F346 HydrophobicContact CD1-CD2 4.37Å; F343-F346 WeakPolarHBondContact O-CD2 3.43Å; F343-F346 PolarHBondContact O-N 3.38Å; M344-F346 PolarHBondContact O-N 3.23Å; M344-F346 VanDerWaalsContact O-N 3.07Å; F346-F371 HydrophobicContact CB-CE1 4.37Å; F346-F371 HydrophobicContact CB-CZ 4.2Å; F346-S376 WeakPolarHBondContact O-CA 3.42Å; F346-S376 WeakPolarHBondContact O-CB 3.2Å; F346-S376 PolarHBondContact O-OG 3.4Å; F346-A380 HydrophobicContact CB-CB 3.81Å; F346-A380 HydrophobicContact CD2-CB 3.71Å; F346-A380 HydrophobicContact CG-CB 3.77Å; F346-A383 HydrophobicContact CD1-CB 4.21Å; F346-A383 HydrophobicContact CE1-CB 3.35Å; F346-A383 HydrophobicContact CZ-CB 3.73Å; F346-M384 HydrophobicContact CD2-CG 4.37Å; F346-M384 HydrophobicContact CE2-CG 3.39Å; F346-M384 HydrophobicContact CE2-SD 3.8Å; F346-M384 HydrophobicContact CZ-CG 3.57Å; F346-M384 HydrophobicContact CZ-SD 3.65Å
347	G	93.8	Very high	94.8	Very high	23 Å²	23	55.2 Å²	55.2	24%	0.237	29%	0.291	C	S	.	.	S	Bend	trans	153.1	-176.3	179	0	0	0	0	0	114.1	M344 V349 S376	M344-G347 PolarHBondContact O-N 3.05Å; M344-G347 VanDerWaalsContact O-N 3.11Å; M344-G347 VanDerWaalsContact O-O 3.04Å; G347-V349 PolarHBondContact O-N 3.01Å; G347-V349 VanDerWaalsContact O-N 3.12Å; G347-S376 WeakPolarHBondContact CA-OG 3.37Å
348	Q	94.3	Very high	94.7	Very high	125 Å²	125	64.4 Å²	64.4	58%	0.584	32%	0.317	S	S	*	.			trans	-72	109.3	-178.5	-176.4	59	69.9	0	0	111	F371 D372	Q348-F371 WeakPolarHBondContact O-CA 3.3Å; Q348-D372 PolarHBondContact O-N 2.72Å; Q348-D372 VanDerWaalsContact O-N 3.14Å
349	V	95.4	Very high	94.7	Very high	11 Å²	11	64.6 Å²	64.6	7%	0.067	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	126.2	170.7	178.9	0	0	0	0	108.7	M340 F343 M344 G347 S351 A352 V369 S370 F371	M340-V349 HydrophobicContact CG-CB 4.43Å; M340-V349 HydrophobicContact CG-CG1 4.19Å; F343-V349 HydrophobicContact CB-CG2 4.2Å; M344-V349 HydrophobicContact CG-CG2 4.46Å; G347-V349 PolarHBondContact O-N 3.01Å; G347-V349 VanDerWaalsContact O-N 3.12Å; V349-S351 WeakPolarHBondContact CG1-O 3.43Å; V349-A352 HydrophobicContact CG1-CB 4.21Å; V349-V369 HydrophobicContact CG1-CG1 4.08Å; V349-V369 HydrophobicContact CG2-CG1 4.15Å; V349-S370 CarbonylContact C-O 3.56Å; V349-S370 WeakPolarHBondContact CA-O 3.26Å; V349-F371 HydrophobicContact CG2-CD1 4.24Å; V349-F371 HydrophobicContact CG2-CE1 3.75Å; V349-F371 HydrophobicContact CG2-CZ 4.19Å
350	I	93.7	Very high	94.6	Very high	52 Å²	52	68.5 Å²	68.5	27%	0.267	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-42	171.4	-67.3	-177	0	0	0	110.3	K317 S370 D372	K317-I350 HydrophobicContact CB-CG2 3.82Å; K317-I350 HydrophobicContact CD-CG2 3.97Å; K317-I350 HydrophobicContact CG-CG2 3.76Å; K317-I350 WeakPolarHBondContact O-CG2 3.44Å; I350-S370 PolarHBondContact N-O 3.25Å; I350-D372 VanDerWaalsContact CD1-CA 3.5Å; I350-D372 HydrophobicContact CD1-CB 3.88Å; I350-D372 HydrophobicContact CG1-CB 4.07Å
351	S	93.1	Very high	94.4	Very high	22 Å²	22	71.7 Å²	71.7	15%	0.154	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	145.2	176.5	59.3	0	0	0	0	111.6	K317 V349 V369 S370	K317-S351 PolarHBondContact O-OG 3.42Å; V349-S351 WeakPolarHBondContact CG1-O 3.43Å; S351-V369 CarbonylContact O-C 3.47Å; S351-V369 WeakPolarHBondContact O-CA 3.45Å; S351-S370 PolarHBondContact N-O 3.36Å; S351-S370 PolarHBondContact O-N 2.95Å; S351-S370 WeakPolarHBondContact OG-CB 3.41Å
352	A	95.8	Very high	94.3	Very high	21 Å²	21	69.9 Å²	69.9	17%	0.174	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	141.4	170.8	0	0	0	0	0	108.8	L339 M340 V349 F368 V369	L339-A352 HydrophobicContact CD2-CB 4.5Å; L339-A352 HydrophobicContact CG-CB 4.41Å; M340-A352 HydrophobicContact CB-CB 3.74Å; M340-A352 HydrophobicContact CG-CB 4.29Å; V349-A352 HydrophobicContact CG1-CB 4.21Å; A352-F368 CarbonylContact C-O 3.56Å; A352-F368 WeakPolarHBondContact CA-O 3.49Å; A352-V369 HydrophobicContact CB-CG2 4.21Å
353	K	95.3	Very high	94.2	Very high	88 Å²	88	68.7 Å²	68.7	38%	0.383	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	125.2	178.7	-172.9	170.9	-171.3	165.5	0	112.4	D336 G367 F368	D336-K353 WeakPolarHBondContact OD1-CA 3.21Å; K353-G367 CarbonylContact O-C 3.43Å; K353-G367 WeakPolarHBondContact O-CA 3.44Å; K353-F368 PolarHBondContact N-O 3.23Å; K353-F368 PolarHBondContact O-N 2.88Å
354	V	96	Very high	94.1	Very high	4 Å²	4	73.6 Å²	73.6	2%	0.024	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	137.7	166.3	179.4	0	0	0	0	108.9	L330 G335 D336 L339 S363	L330-V354 HydrophobicContact CD1-CG2 3.99Å; G335-V354 VanDerWaalsContact C-CG2 3.46Å; G335-V354 VanDerWaalsContact O-CG2 3.32Å; G335-V354 WeakPolarHBondContact O-CG2 3.43Å; D336-V354 PolarHBondContact OD1-N 3.46Å; L339-V354 HydrophobicContact CB-CG2 4.02Å; L339-V354 HydrophobicContact CD2-CG2 3.81Å; V354-S363 WeakPolarHBondContact CG1-OG 3.44Å
355	F	94.8	Very high	94.1	Very high	62 Å²	62	70.4 Å²	70.4	27%	0.272	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	117	176.1	-73.4	-96.1	0	0	0	109.7	K364 F366 F368	F355-K364 VanDerWaalsContact O-CB 3.23Å; F355-K364 WeakPolarHBondContact O-CB 3.29Å; F355-K364 WeakPolarHBondContact O-CG 3.42Å; F355-K364 PolarHBondContact O-N 2.93Å; F355-F366 HydrophobicContact CB-CD1 4.44Å; F355-F366 HydrophobicContact CB-CD2 4.16Å; F355-F366 HydrophobicContact CB-CE1 3.96Å; F355-F366 HydrophobicContact CB-CE2 3.65Å; F355-F366 HydrophobicContact CB-CZ 3.53Å; F355-F366 HydrophobicContact CD1-CE2 4.1Å; F355-F366 HydrophobicContact CD1-CZ 4.19Å; F355-F366 AromaticContact CD2-CD2 3.61Å; F355-F366 HydrophobicContact CD2-CD2 3.61Å; F355-F366 AromaticContact CD2-CE2 3.23Å; F355-F366 HydrophobicContact CD2-CE2 3.23Å; F355-F366 HydrophobicContact CD2-CZ 4.01Å; F355-F366 HydrophobicContact CE2-CD2 4.31Å; F355-F366 AromaticContact CE2-CE2 3.86Å; F355-F366 HydrophobicContact CE2-CE2 3.86Å; F355-F366 HydrophobicContact CG-CD2 4.08Å; F355-F366 AromaticContact CG-CE2 3.37Å; F355-F366 HydrophobicContact CG-CE2 3.37Å; F355-F366 AromaticContact CG-CZ 3.64Å; F355-F366 HydrophobicContact CG-CZ 3.64Å; F355-F366 HydrophobicContact CZ-CE2 4.5Å; F355-F366 PolarHBondContact N-O 2.82Å; F355-F368 HydrophobicContact CE2-CB 3.93Å
356	I	93.8	Very high	94.1	Very high	94 Å²	94	68.1 Å²	68.1	48%	0.482	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	146.2	176.7	-61	175.3	0	0	0	109.2
357	D	93.6	Very high	94.1	Very high	45 Å²	45	65.8 Å²	65.8	24%	0.241	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-80.5	119.9	170.7	-176.7	48.3	0	0	0	111.7	A359 T360 N361 Q362 K364	D357-A359 VanDerWaalsContact C-N 3.26Å; D357-A359 PolarHBondContact O-N 3.47Å; D357-T360 WeakPolarHBondContact CB-OG1 3.47Å; D357-T360 PolarHBondContact O-N 3.24Å; D357-T360 PolarHBondContact OD2-N 3Å; D357-T360 PolarHBondContact OD2-OG1 2.96Å; D357-N361 WeakPolarHBondContact O-CA 3.45Å; D357-N361 PolarHBondContact O-N 3.23Å; D357-Q362 PolarHBondContact N-O 3.21Å; D357-K364 HydrophobicContact CB-CG 4.12Å; D357-K364 WeakPolarHBondContact OD1-CE 3.34Å; D357-K364 IonicContact OD1-NZ 3.38Å; D357-K364 PolarHBondContact OD1-NZ 3.13Å
358	R	91.3	Very high	94.2	Very high	234 Å²	234	64.9 Å²	64.9	88%	0.883	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-20.8	-174.2	-169	175.9	-180	-170	0.2	113.6
359	A	93.1	Very high	94.3	Very high	90 Å²	90	59 Å²	59	74%	0.744	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-40.1	178.4	0	0	0	0	0	112.2	D357	D357-A359 VanDerWaalsContact C-N 3.26Å; D357-A359 PolarHBondContact O-N 3.47Å
360	T	94.3	Very high	94.3	Very high	83 Å²	83	58.4 Å²	58.4	51%	0.509	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-12.1	-175.6	56.5	0	0	0	0	114.4	D357 Q362	D357-T360 WeakPolarHBondContact CB-OG1 3.47Å; D357-T360 PolarHBondContact O-N 3.24Å; D357-T360 PolarHBondContact OD2-N 3Å; D357-T360 PolarHBondContact OD2-OG1 2.96Å; T360-Q362 PolarHBondContact O-N 2.87Å; T360-Q362 PolarHBondContact OG1-N 2.84Å
361	N	91.4	Very high	94.5	Very high	126 Å²	126	56 Å²	56	67%	0.674	29%	0.286	S	S	*	.			trans	54.7	21.3	-166.6	-64.5	-67.8	0	0	0	114.4	D357	D357-N361 WeakPolarHBondContact O-CA 3.45Å; D357-N361 PolarHBondContact O-N 3.23Å
362	Q	91.7	Very high	94.5	Very high	95 Å²	95	58.3 Å²	58.3	44%	0.444	30%	0.297	S	S	.	.			trans	-95.6	145.6	177.8	-61.2	-62.3	-7.8	0	0	112	Q332 D357 T360 K364	Q332-Q362 VanDerWaalsContact NE2-CD 3.28Å; D357-Q362 PolarHBondContact N-O 3.21Å; T360-Q362 PolarHBondContact O-N 2.87Å; T360-Q362 PolarHBondContact OG1-N 2.84Å; Q362-K364 PolarHBondContact O-N 2.93Å
363	S	93.1	Very high	94.3	Very high	16 Å²	16	59.8 Å²	59.8	11%	0.112	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	130.2	173.3	175.8	0	0	0	0	111	Q332 V354 C365	Q332-S363 WeakPolarHBondContact O-CB 3.33Å; V354-S363 WeakPolarHBondContact CG1-OG 3.44Å; S363-C365 PolarHBondContact O-N 3.04Å; S363-C365 VanDerWaalsContact O-N 3.08Å; S363-C365 PolarHBondContact OG-N 3.42Å; S363-C365 VanDerWaalsContact OG-N 3.13Å
364	K	94.7	Very high	94.3	Very high	104 Å²	104	57.9 Å²	57.9	45%	0.452	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	7.4	171.4	-58.2	-166.2	179	-156	0	112.6	F355 D357 Q362 F366	F355-K364 VanDerWaalsContact O-CB 3.23Å; F355-K364 WeakPolarHBondContact O-CB 3.29Å; F355-K364 WeakPolarHBondContact O-CG 3.42Å; F355-K364 PolarHBondContact O-N 2.93Å; D357-K364 HydrophobicContact CB-CG 4.12Å; D357-K364 WeakPolarHBondContact OD1-CE 3.34Å; D357-K364 IonicContact OD1-NZ 3.38Å; D357-K364 PolarHBondContact OD1-NZ 3.13Å; Q362-K364 PolarHBondContact O-N 2.93Å; K364-F366 HydrophobicContact CB-CD1 3.62Å; K364-F366 HydrophobicContact CB-CE1 3.5Å; K364-F366 HydrophobicContact CD-CE1 3.93Å; K364-F366 HydrophobicContact CG-CE1 4.31Å; K364-F366 WeakPolarHBondContact O-CD1 3.1Å; K364-F366 PolarHBondContact O-N 3.46Å
365	C	94.2	Very high	94.2	Very high	29 Å²	29	61.2 Å²	61.2	20%	0.196	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59.3	25.2	180	-59.2	0	0	0	0	113.7	H329 L330 S363	H329-C365 PolarHBondContact N-O 3.05Å; L330-C365 PolarHBondContact N-O 3.47Å; L330-C365 VanDerWaalsContact O-CB 3.29Å; L330-C365 WeakPolarHBondContact O-CB 3.12Å; S363-C365 PolarHBondContact O-N 3.04Å; S363-C365 VanDerWaalsContact O-N 3.08Å; S363-C365 PolarHBondContact OG-N 3.42Å; S363-C365 VanDerWaalsContact OG-N 3.13Å
366	F	96.4	Very high	94.3	Very high	57 Å²	57	59 Å²	59	25%	0.25	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	153.1	171.2	78.7	-91.6	0	0	0	111.7	I327 Y328 F355 K364	I327-F366 CarbonylContact O-C 3.53Å; I327-F366 WeakPolarHBondContact O-CA 3.48Å; I327-F366 WeakPolarHBondContact O-CB 3.21Å; Y328-F366 HydrophobicContact CD1-CB 3.76Å; Y328-F366 HydrophobicContact CD1-CG 4.43Å; Y328-F366 HydrophobicContact CE1-CB 4.28Å; Y328-F366 HydrophobicContact CG-CB 4.38Å; F355-F366 HydrophobicContact CB-CD1 4.44Å; F355-F366 HydrophobicContact CB-CD2 4.16Å; F355-F366 HydrophobicContact CB-CE1 3.96Å; F355-F366 HydrophobicContact CB-CE2 3.65Å; F355-F366 HydrophobicContact CB-CZ 3.53Å; F355-F366 HydrophobicContact CD1-CE2 4.1Å; F355-F366 HydrophobicContact CD1-CZ 4.19Å; F355-F366 AromaticContact CD2-CD2 3.61Å; F355-F366 HydrophobicContact CD2-CD2 3.61Å; F355-F366 AromaticContact CD2-CE2 3.23Å; F355-F366 HydrophobicContact CD2-CE2 3.23Å; F355-F366 HydrophobicContact CD2-CZ 4.01Å; F355-F366 HydrophobicContact CE2-CD2 4.31Å; F355-F366 AromaticContact CE2-CE2 3.86Å; F355-F366 HydrophobicContact CE2-CE2 3.86Å; F355-F366 HydrophobicContact CG-CD2 4.08Å; F355-F366 AromaticContact CG-CE2 3.37Å; F355-F366 HydrophobicContact CG-CE2 3.37Å; F355-F366 AromaticContact CG-CZ 3.64Å; F355-F366 HydrophobicContact CG-CZ 3.64Å; F355-F366 HydrophobicContact CZ-CE2 4.5Å; F355-F366 PolarHBondContact N-O 2.82Å; K364-F366 HydrophobicContact CB-CD1 3.62Å; K364-F366 HydrophobicContact CB-CE1 3.5Å; K364-F366 HydrophobicContact CD-CE1 3.93Å; K364-F366 HydrophobicContact CG-CE1 4.31Å; K364-F366 WeakPolarHBondContact O-CD1 3.1Å; K364-F366 PolarHBondContact O-N 3.46Å
367	G	96.2	Very high	94.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	173.8	-177.2	0	0	0	0	0	112.8	F326 I327 K353	F326-G367 WeakPolarHBondContact CA-O 3.23Å; I327-G367 PolarHBondContact N-O 3.41Å; I327-G367 PolarHBondContact O-N 3.2Å; K353-G367 CarbonylContact O-C 3.43Å; K353-G367 WeakPolarHBondContact O-CA 3.44Å
368	F	96.6	Very high	94.5	Very high	5 Å²	5	56.2 Å²	56.2	2%	0.022	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.1	177.4	175.4	-104.2	0	0	0	108.9	E318 N324 L325 F326 A352 K353 F355 K399	E318-F368 HydrophobicContact CG-CE1 4.22Å; E318-F368 HydrophobicContact CG-CZ 4.01Å; N324-F368 HydrophobicContact CB-CE2 3.91Å; N324-F368 HydrophobicContact CB-CZ 4.05Å; N324-F368 WeakPolarHBondContact OD1-CZ 3.14Å; L325-F368 WeakPolarHBondContact O-CA 3.32Å; L325-F368 WeakPolarHBondContact O-CD2 3.2Å; F326-F368 HydrophobicContact CD1-CD2 4.36Å; F326-F368 HydrophobicContact CE1-CB 4.48Å; F326-F368 HydrophobicContact CE1-CD2 4.18Å; A352-F368 CarbonylContact C-O 3.56Å; A352-F368 WeakPolarHBondContact CA-O 3.49Å; K353-F368 PolarHBondContact N-O 3.23Å; K353-F368 PolarHBondContact O-N 2.88Å; F355-F368 HydrophobicContact CE2-CB 3.93Å; F368-K399 HydrophobicContact CD2-CD 4.42Å; F368-K399 HydrophobicContact CE2-CB 4.48Å; F368-K399 HydrophobicContact CE2-CD 3.6Å; F368-K399 HydrophobicContact CZ-CD 4.32Å
369	V	96.7	Very high	94.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.2	172.1	175.1	0	0	0	0	108.2	L325 I327 L339 F343 V349 S351 A352 F371	L325-V369 PolarHBondContact N-O 3.25Å; L325-V369 PolarHBondContact O-N 3.02Å; I327-V369 HydrophobicContact CD1-CB 3.83Å; I327-V369 HydrophobicContact CD1-CG2 3.6Å; L339-V369 HydrophobicContact CD1-CG2 3.88Å; L339-V369 HydrophobicContact CD2-CG2 3.93Å; L339-V369 HydrophobicContact CG-CG2 3.67Å; F343-V369 HydrophobicContact CB-CG1 3.98Å; F343-V369 HydrophobicContact CB-CG2 4.39Å; F343-V369 HydrophobicContact CD1-CB 4.49Å; F343-V369 HydrophobicContact CD1-CG1 4.2Å; F343-V369 HydrophobicContact CD1-CG2 4.43Å; F343-V369 HydrophobicContact CD2-CG2 4.2Å; F343-V369 HydrophobicContact CG-CG1 4.18Å; F343-V369 HydrophobicContact CG-CG2 4.08Å; V349-V369 HydrophobicContact CG1-CG1 4.08Å; V349-V369 HydrophobicContact CG2-CG1 4.15Å; S351-V369 CarbonylContact O-C 3.47Å; S351-V369 WeakPolarHBondContact O-CA 3.45Å; A352-V369 HydrophobicContact CB-CG2 4.21Å; V369-F371 HydrophobicContact CG1-CD2 4.2Å; V369-F371 HydrophobicContact CG1-CE2 3.75Å; V369-F371 HydrophobicContact CG1-CZ 4.14Å
370	S	95.5	Very high	95	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.3	178.9	-168.4	0	0	0	0	109.9	G319 N324 V349 I350 S351	G319-S370 PolarHBondContact N-OG 3.46Å; N324-S370 WeakPolarHBondContact OD1-CB 3.05Å; N324-S370 PolarHBondContact OD1-OG 3.02Å; V349-S370 CarbonylContact C-O 3.56Å; V349-S370 WeakPolarHBondContact CA-O 3.26Å; I350-S370 PolarHBondContact N-O 3.25Å; S351-S370 PolarHBondContact N-O 3.36Å; S351-S370 PolarHBondContact O-N 2.95Å; S351-S370 WeakPolarHBondContact OG-CB 3.41Å
371	F	96.5	Very high	95.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	160.4	174.1	-71.9	-84.1	0	0	0	111.3	C323 L325 F343 F346 Q348 V349 V369 N373 A377 A380	C323-F371 HydrophobicContact CB-CB 4.41Å; C323-F371 WeakPolarHBondContact CB-O 3.42Å; C323-F371 PolarHBondContact O-N 2.88Å; L325-F371 HydrophobicContact CD1-CD2 4.22Å; L325-F371 HydrophobicContact CD1-CE2 3.75Å; F343-F371 HydrophobicContact CB-CZ 4.02Å; F343-F371 HydrophobicContact CD1-CE2 4.09Å; F343-F371 HydrophobicContact CD1-CZ 4.01Å; F346-F371 HydrophobicContact CB-CE1 4.37Å; F346-F371 HydrophobicContact CB-CZ 4.2Å; Q348-F371 WeakPolarHBondContact O-CA 3.3Å; V349-F371 HydrophobicContact CG2-CD1 4.24Å; V349-F371 HydrophobicContact CG2-CE1 3.75Å; V349-F371 HydrophobicContact CG2-CZ 4.19Å; V369-F371 HydrophobicContact CG1-CD2 4.2Å; V369-F371 HydrophobicContact CG1-CE2 3.75Å; V369-F371 HydrophobicContact CG1-CZ 4.14Å; F371-N373 VanDerWaalsContact C-N 3.31Å; F371-A377 HydrophobicContact CB-CB 4.4Å; F371-A377 HydrophobicContact CD2-CB 3.91Å; F371-A377 HydrophobicContact CG-CB 4.46Å; F371-A380 HydrophobicContact CE2-CB 3.84Å; F371-A380 HydrophobicContact CZ-CB 3.91Å
372	D	93.7	Very high	95.4	Very high	72 Å²	72	41.4 Å²	41.4	39%	0.385	22%	0.219	S	C	.	.	S	Bend	trans	-70.6	-25.9	171	69.1	-24.5	0	0	0	113.7	P320 Q348 I350	P320-D372 WeakPolarHBondContact CD-O 3.36Å; Q348-D372 PolarHBondContact O-N 2.72Å; Q348-D372 VanDerWaalsContact O-N 3.14Å; I350-D372 VanDerWaalsContact CD1-CA 3.5Å; I350-D372 HydrophobicContact CD1-CB 3.88Å; I350-D372 HydrophobicContact CG1-CB 4.07Å
373	N	92.3	Very high	95.6	Very high	51 Å²	51	39.4 Å²	39.4	27%	0.273	22%	0.219	S	C	.	.	S	Bend	trans	-139	154.5	-175.9	81.6	85	0	0	0	112.8	F371 V375 S376 A377	F371-N373 VanDerWaalsContact C-N 3.31Å; N373-V375 WeakPolarHBondContact OD1-CA 3.37Å; N373-V375 VanDerWaalsContact OD1-CB 3.31Å; N373-V375 WeakPolarHBondContact OD1-CB 3.45Å; N373-V375 PolarHBondContact OD1-N 3.49Å; N373-S376 WeakPolarHBondContact ND2-CB 3.49Å; N373-S376 PolarHBondContact ND2-OG 3.46Å; N373-S376 PolarHBondContact OD1-N 2.71Å; N373-S376 PolarHBondContact OD1-OG 3.23Å; N373-A377 PolarHBondContact O-N 3.16Å
374	S	93.6	Very high	95.7	Very high	49 Å²	49	39.3 Å²	39.3	34%	0.343	22%	0.217	S	C	.	.	H	α-helix	trans	-77.2	-22.8	-175.4	56.6	0	0	0	0	113.4	C323 A377 Q378	C323-S374 PolarHBondContact SG-N 2.9Å; S374-A377 PolarHBondContact O-N 2.87Å; S374-Q378 WeakPolarHBondContact O-CG 3.4Å; S374-Q378 PolarHBondContact O-N 3.33Å
375	V	95.5	Very high	95.8	Very high	74 Å²	74	38.2 Å²	38.2	45%	0.448	22%	0.216	S	C	.	.	H	α-helix	trans	-68.4	-46.5	179	-172.9	0	0	0	0	110	Y29 N373 Q378 A379	Y29-V375 HydrophobicContact CE1-CG2 4.08Å; Y29-V375 WeakPolarHBondContact OH-CG2 3.4Å; N373-V375 WeakPolarHBondContact OD1-CA 3.37Å; N373-V375 VanDerWaalsContact OD1-CB 3.31Å; N373-V375 WeakPolarHBondContact OD1-CB 3.45Å; N373-V375 PolarHBondContact OD1-N 3.49Å; V375-Q378 PolarHBondContact O-N 2.95Å; V375-A379 WeakPolarHBondContact O-CB 3.5Å; V375-A379 PolarHBondContact O-N 3.06Å
376	S	96	Very high	95.9	Very high	15 Å²	15	38.4 Å²	38.4	11%	0.105	22%	0.223	C	C	.	.	H	α-helix	trans	-60.8	-42.5	172.8	-70.3	0	0	0	0	112.6	F346 G347 N373 Q378 A379 A380	F346-S376 WeakPolarHBondContact O-CA 3.42Å; F346-S376 WeakPolarHBondContact O-CB 3.2Å; F346-S376 PolarHBondContact O-OG 3.4Å; G347-S376 WeakPolarHBondContact CA-OG 3.37Å; N373-S376 WeakPolarHBondContact ND2-CB 3.49Å; N373-S376 PolarHBondContact ND2-OG 3.46Å; N373-S376 PolarHBondContact OD1-N 2.71Å; N373-S376 PolarHBondContact OD1-OG 3.23Å; S376-Q378 VanDerWaalsContact C-N 3.34Å; S376-Q378 PolarHBondContact O-N 2.77Å; S376-A379 PolarHBondContact O-N 3.3Å; S376-A380 WeakPolarHBondContact O-CB 3.46Å; S376-A380 PolarHBondContact O-N 3.08Å
377	A	96.2	Very high	95.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62.1	-40.3	175.1	0	0	0	0	0	112.4	L325 F371 N373 S374 I381	L325-A377 HydrophobicContact CD2-CB 4.15Å; L325-A377 HydrophobicContact CG-CB 4.37Å; F371-A377 HydrophobicContact CB-CB 4.4Å; F371-A377 HydrophobicContact CD2-CB 3.91Å; F371-A377 HydrophobicContact CG-CB 4.46Å; N373-A377 PolarHBondContact O-N 3.16Å; S374-A377 PolarHBondContact O-N 2.87Å; A377-I381 WeakPolarHBondContact O-CG1 3.44Å; A377-I381 PolarHBondContact O-N 3.27Å; A377-I381 VanDerWaalsContact O-N 3.1Å
378	Q	96.2	Very high	95.8	Very high	81 Å²	81	45.4 Å²	45.4	38%	0.379	26%	0.255	S	S	.	.	H	α-helix	trans	-68	-45	173.9	-69.8	-60	-34.7	0	0	112.1	S374 V375 S376 A380 I381 H382	S374-Q378 WeakPolarHBondContact O-CG 3.4Å; S374-Q378 PolarHBondContact O-N 3.33Å; V375-Q378 PolarHBondContact O-N 2.95Å; S376-Q378 VanDerWaalsContact C-N 3.34Å; S376-Q378 PolarHBondContact O-N 2.77Å; Q378-A380 VanDerWaalsContact C-N 3.3Å; Q378-A380 PolarHBondContact O-N 3Å; Q378-I381 WeakPolarHBondContact O-CB 3.33Å; Q378-I381 PolarHBondContact O-N 2.98Å; Q378-I381 VanDerWaalsContact O-N 3.11Å; Q378-H382 PolarHBondContact O-N 2.78Å; Q378-H382 PolarHBondContact O-ND1 3.44Å
379	A	96.6	Very high	95.4	Very high	45 Å²	45	46.6 Å²	46.6	37%	0.372	26%	0.262	S	S	.	.	H	α-helix	trans	-57.1	-44.3	176.7	0	0	0	0	0	111.6	V375 S376 I381 H382 A383	V375-A379 WeakPolarHBondContact O-CB 3.5Å; V375-A379 PolarHBondContact O-N 3.06Å; S376-A379 PolarHBondContact O-N 3.3Å; A379-I381 PolarHBondContact O-N 3.42Å; A379-H382 PolarHBondContact O-N 3.22Å; A379-A383 PolarHBondContact O-N 3.23Å
380	A	97.3	Very high	95	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.1	-42	174.4	0	0	0	0	0	112.8	L325 F343 F346 F371 S376 Q378 M384	L325-A380 HydrophobicContact CD1-CB 3.93Å; F343-A380 HydrophobicContact CD1-CB 3.86Å; F343-A380 HydrophobicContact CE1-CB 3.98Å; F346-A380 HydrophobicContact CB-CB 3.81Å; F346-A380 HydrophobicContact CD2-CB 3.71Å; F346-A380 HydrophobicContact CG-CB 3.77Å; F371-A380 HydrophobicContact CE2-CB 3.84Å; F371-A380 HydrophobicContact CZ-CB 3.91Å; S376-A380 WeakPolarHBondContact O-CB 3.46Å; S376-A380 PolarHBondContact O-N 3.08Å; Q378-A380 VanDerWaalsContact C-N 3.3Å; Q378-A380 PolarHBondContact O-N 3Å; A380-M384 VanDerWaalsContact O-CB 3.25Å; A380-M384 WeakPolarHBondContact O-CB 3.38Å; A380-M384 PolarHBondContact O-N 3.34Å
381	I	97	Very high	94.8	Very high	26 Å²	26	59.2 Å²	59.2	13%	0.133	34%	0.341	C	S	.	.	H	α-helix	trans	-59.2	-48	173.1	-69.1	161.5	0	0	0	110.5	L325 A377 Q378 A379 A383 N385 V396 L398	L325-I381 HydrophobicContact CD1-CG1 4.36Å; L325-I381 HydrophobicContact CD2-CD1 3.56Å; L325-I381 HydrophobicContact CD2-CG1 3.65Å; A377-I381 WeakPolarHBondContact O-CG1 3.44Å; A377-I381 PolarHBondContact O-N 3.27Å; A377-I381 VanDerWaalsContact O-N 3.1Å; Q378-I381 WeakPolarHBondContact O-CB 3.33Å; Q378-I381 PolarHBondContact O-N 2.98Å; Q378-I381 VanDerWaalsContact O-N 3.11Å; A379-I381 PolarHBondContact O-N 3.42Å; I381-A383 VanDerWaalsContact C-N 3.34Å; I381-A383 PolarHBondContact O-N 3.44Å; I381-N385 HydrophobicContact CG2-CB 4.4Å; I381-N385 WeakPolarHBondContact O-CB 3.38Å; I381-N385 PolarHBondContact O-N 2.77Å; I381-V396 HydrophobicContact CG1-CG1 3.91Å; I381-L398 HydrophobicContact CD1-CB 4.5Å; I381-L398 HydrophobicContact CD1-CD1 4.38Å
382	H	96.6	Very high	94.6	Very high	150 Å²	150	63.6 Å²	63.6	69%	0.694	36%	0.36	S	S	*	.	H	α-helix	trans	-67.5	-33.7	-174.6	-71.8	68.2	0	0	0	112.7	Q378 A379	Q378-H382 PolarHBondContact O-N 2.78Å; Q378-H382 PolarHBondContact O-ND1 3.44Å; A379-H382 PolarHBondContact O-N 3.22Å
383	A	96.1	Very high	94.7	Very high	53 Å²	53	67 Å²	67	44%	0.438	37%	0.367	S	S	.	.	H	α-helix	trans	-84.8	-39.3	179.1	0	0	0	0	0	113.9	F346 A379 I381	F346-A383 HydrophobicContact CD1-CB 4.21Å; F346-A383 HydrophobicContact CE1-CB 3.35Å; F346-A383 HydrophobicContact CZ-CB 3.73Å; A379-A383 PolarHBondContact O-N 3.23Å; I381-A383 VanDerWaalsContact C-N 3.34Å; I381-A383 PolarHBondContact O-N 3.44Å
384	M	96.5	Very high	94.9	Very high	14 Å²	14	64.7 Å²	64.7	7%	0.069	36%	0.355	C	S	.	.	H	α-helix	trans	-100.3	-18	-169.7	-61.3	-59.7	-62.8	0	0	114.3	M342 F343 F346 A380 G386 F387 L394 V396	M342-M384 HydrophobicContact CE-CE 4.21Å; M342-M384 HydrophobicContact CG-CE 3.54Å; M342-M384 HydrophobicContact SD-CE 3.46Å; M342-M384 WeakPolarHBondContact SD-CE 3.1Å; F343-M384 HydrophobicContact CE1-CB 4.39Å; F343-M384 HydrophobicContact CE1-CG 4.29Å; F343-M384 HydrophobicContact CZ-CB 4.08Å; F343-M384 HydrophobicContact CZ-CG 4.15Å; F346-M384 HydrophobicContact CD2-CG 4.37Å; F346-M384 HydrophobicContact CE2-CG 3.39Å; F346-M384 HydrophobicContact CE2-SD 3.8Å; F346-M384 HydrophobicContact CZ-CG 3.57Å; F346-M384 HydrophobicContact CZ-SD 3.65Å; A380-M384 VanDerWaalsContact O-CB 3.25Å; A380-M384 WeakPolarHBondContact O-CB 3.38Å; A380-M384 PolarHBondContact O-N 3.34Å; M384-G386 PolarHBondContact O-N 3.29Å; M384-F387 HydrophobicContact CE-CB 4.32Å; M384-F387 HydrophobicContact CE-CD1 4.07Å; M384-F387 HydrophobicContact CE-CG 4.06Å; M384-F387 VanDerWaalsContact O-CB 3.23Å; M384-F387 WeakPolarHBondContact O-CB 3.5Å; M384-F387 PolarHBondContact O-N 2.91Å; M384-L394 HydrophobicContact CE-CD1 3.82Å; M384-V396 HydrophobicContact CB-CG2 3.83Å
385	N	96.5	Very high	95.1	Very high	82 Å²	82	66.8 Å²	66.8	44%	0.439	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	118.9	176.4	-172.4	46.1	0	0	0	110.7	I381 K395 V396	I381-N385 HydrophobicContact CG2-CB 4.4Å; I381-N385 WeakPolarHBondContact O-CB 3.38Å; I381-N385 PolarHBondContact O-N 2.77Å; N385-K395 WeakPolarHBondContact OD1-CA 3.28Å; N385-V396 HydrophobicContact CB-CB 4.11Å; N385-V396 PolarHBondContact OD1-N 3.01Å; N385-V396 PolarHBondContact OD1-O 3.42Å
386	G	95.6	Very high	95.2	Very high	32 Å²	32	63.4 Å²	63.4	33%	0.33	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	-5.1	-173.7	0	0	0	0	0	114.7	M384 Q388 R393 L394	M384-G386 PolarHBondContact O-N 3.29Å; G386-Q388 PolarHBondContact O-N 3.04Å; G386-R393 PolarHBondContact O-NH1 2.91Å; G386-L394 WeakPolarHBondContact CA-O 3.27Å; G386-L394 PolarHBondContact N-O 2.74Å
387	F	95.3	Very high	95.2	Very high	94 Å²	94	66.3 Å²	66.3	41%	0.412	35%	0.349	S	S	.	.			trans	-56.5	128.9	177.4	-177.4	-93.1	0	0	0	110.7	M384 I389 R393 L394	M384-F387 HydrophobicContact CE-CB 4.32Å; M384-F387 HydrophobicContact CE-CD1 4.07Å; M384-F387 HydrophobicContact CE-CG 4.06Å; M384-F387 VanDerWaalsContact O-CB 3.23Å; M384-F387 WeakPolarHBondContact O-CB 3.5Å; M384-F387 PolarHBondContact O-N 2.91Å; F387-I389 HydrophobicContact CD1-CB 4.46Å; F387-I389 HydrophobicContact CE1-CB 4.39Å; F387-R393 CarbonylContact O-C 3.42Å; F387-R393 WeakPolarHBondContact O-CA 3.39Å; F387-L394 HydrophobicContact CB-CD1 4.38Å; F387-L394 HydrophobicContact CD1-CD1 3.98Å; F387-L394 PolarHBondContact O-N 3.23Å
388	Q	94.6	Very high	95.1	Very high	110 Å²	110	69.7 Å²	69.7	51%	0.514	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	126.3	-176.2	-175.6	172.2	-25.3	0	0	110.6	G386 K392 R393	G386-Q388 PolarHBondContact O-N 3.04Å; Q388-K392 WeakPolarHBondContact CA-O 3.33Å; Q388-R393 HydrophobicContact CB-CG 4.44Å
389	I	89.1	Confident	94.9	Very high	31 Å²	31	68.1 Å²	68.1	16%	0.159	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	116.4	176.5	-168.7	161.8	0	0	0	109.5	P331 F334 M342 F387 M391 K392 L394	P331-I389 HydrophobicContact CG-CB 4.49Å; P331-I389 HydrophobicContact CG-CD1 3.6Å; P331-I389 HydrophobicContact CG-CG1 3.73Å; P331-I389 HydrophobicContact CG-CG2 3.99Å; F334-I389 HydrophobicContact CE1-CD1 4.3Å; F334-I389 HydrophobicContact CE2-CD1 3.63Å; F334-I389 HydrophobicContact CZ-CD1 3.47Å; F334-I389 VanDerWaalsContact CZ-CD1 3.47Å; M342-I389 HydrophobicContact CE-CD1 4.03Å; F387-I389 HydrophobicContact CD1-CB 4.46Å; F387-I389 HydrophobicContact CE1-CB 4.39Å; I389-M391 PolarHBondContact O-N 2.77Å; I389-K392 PolarHBondContact N-O 2.84Å; I389-K392 PolarHBondContact O-N 2.86Å; I389-L394 HydrophobicContact CG2-CD2 3.74Å; I389-L394 HydrophobicContact CG2-CG 3.88Å
390	G	88.6	Confident	94.3	Very high	66 Å²	66	76.5 Å²	76.5	68%	0.68	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	-122.7	-166	0	0	0	0	0	111.6
391	M	90.1	Very high	93.3	Very high	199 Å²	199	79.5 Å²	79.5	98%	0.98	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	1.9	178.1	-59.3	-177.7	-71.1	0	0	114	I389	I389-M391 PolarHBondContact O-N 2.77Å
392	K	93.1	Very high	92	Very high	92 Å²	92	86.9 Å²	86.9	40%	0.4	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	160.8	-175	-68.6	175.5	-179.7	170.7	0	111.2	H329 Q388 I389	H329-K392 HydrophobicContact CB-CB 4.28Å; H329-K392 HydrophobicContact CB-CD 4.34Å; Q388-K392 WeakPolarHBondContact CA-O 3.33Å; I389-K392 PolarHBondContact N-O 2.84Å; I389-K392 PolarHBondContact O-N 2.86Å
393	R	95.8	Very high	90.2	Very high	143 Å²	143	87.2 Å²	87.2	54%	0.54	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	125.2	166.4	-69.2	-174.6	-179.3	-74.7	-10.9	109.6	H329 G386 F387 Q388	H329-R393 WeakPolarHBondContact CB-O 3.36Å; H329-R393 PolarHBondContact ND1-O 3.21Å; G386-R393 PolarHBondContact O-NH1 2.91Å; F387-R393 CarbonylContact O-C 3.42Å; F387-R393 WeakPolarHBondContact O-CA 3.39Å; Q388-R393 HydrophobicContact CB-CG 4.44Å
394	L	96.9	Very high	88.3	Confident	2 Å²	2	90 Å²	90	1%	0.01	45%	0.449	C	S	.	.			trans	-60.1	139.2	175.4	-64.4	-176.9	0	0	0	110	I327 Y328 L330 M342 M384 G386 F387 I389	I327-L394 HydrophobicContact CG2-CD2 4.39Å; Y328-L394 WeakPolarHBondContact O-CA 3.31Å; L330-L394 HydrophobicContact CD2-CD2 3.91Å; M342-L394 HydrophobicContact SD-CD1 3.93Å; M384-L394 HydrophobicContact CE-CD1 3.82Å; G386-L394 WeakPolarHBondContact CA-O 3.27Å; G386-L394 PolarHBondContact N-O 2.74Å; F387-L394 HydrophobicContact CB-CD1 4.38Å; F387-L394 HydrophobicContact CD1-CD1 3.98Å; F387-L394 PolarHBondContact O-N 3.23Å; I389-L394 HydrophobicContact CG2-CD2 3.74Å; I389-L394 HydrophobicContact CG2-CG 3.88Å
395	K	97.4	Very high	86.3	Confident	94 Å²	94	94.2 Å²	94.2	41%	0.409	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	113.9	171.5	-173.9	-174.8	-173.9	-170.1	0	108.4	Y328 N385 Q397	Y328-K395 PolarHBondContact N-O 3.31Å; Y328-K395 PolarHBondContact O-N 3.1Å; N385-K395 WeakPolarHBondContact OD1-CA 3.28Å; K395-Q397 VanDerWaalsContact CE-NE2 3.33Å; K395-Q397 HydrophobicContact CG-CG 4.41Å
396	V	97.3	Very high	84.2	Confident	3 Å²	3	100.9 Å²	100.9	2%	0.018	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	125.7	-177.8	-171.6	0	0	0	0	108.5	L325 F326 I327 F343 I381 M384 N385	L325-V396 HydrophobicContact CB-CG1 4.45Å; L325-V396 HydrophobicContact CD1-CG1 3.9Å; F326-V396 WeakPolarHBondContact O-CA 3.44Å; I327-V396 HydrophobicContact CG1-CG1 4.41Å; I327-V396 HydrophobicContact CG1-CG2 4.37Å; I327-V396 HydrophobicContact CG2-CG2 4.36Å; F343-V396 HydrophobicContact CE1-CG1 4.26Å; F343-V396 HydrophobicContact CZ-CG1 4.47Å; F343-V396 HydrophobicContact CZ-CG2 4.12Å; I381-V396 HydrophobicContact CG1-CG1 3.91Å; M384-V396 HydrophobicContact CB-CG2 3.83Å; N385-V396 HydrophobicContact CB-CB 4.11Å; N385-V396 PolarHBondContact OD1-N 3.01Å; N385-V396 PolarHBondContact OD1-O 3.42Å
397	Q	95.8	Very high	82.6	Confident	75 Å²	75	105.5 Å²	105.5	35%	0.35	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	148.6	-176	-74.3	169.1	98.2	0	0	110.5	L325 F326 K395	L325-Q397 CarbonylContact C-O 3.57Å; L325-Q397 WeakPolarHBondContact CA-O 3.31Å; F326-Q397 PolarHBondContact N-O 2.85Å; F326-Q397 PolarHBondContact O-N 2.9Å; K395-Q397 VanDerWaalsContact CE-NE2 3.33Å; K395-Q397 HydrophobicContact CG-CG 4.41Å
398	L	94.9	Very high	80.2	Confident	71 Å²	71	115.2 Å²	115.2	37%	0.372	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-64	136.8	169.6	-159	70.9	0	0	0	110.5	G322 L325 I381 R400	G322-L398 WeakPolarHBondContact O-CD1 3.33Å; L325-L398 HydrophobicContact CD2-CD1 4.06Å; I381-L398 HydrophobicContact CD1-CB 4.5Å; I381-L398 HydrophobicContact CD1-CD1 4.38Å; L398-R400 PolarHBondContact O-N 3.34Å
399	K	91.8	Very high	79.5	Confident	48 Å²	48	115.5 Å²	115.5	21%	0.209	56%	0.562	C	S	.	*	P	Polyproline II helix	trans	-60.6	123.7	169.8	171.2	165	173.9	-120.3	0	108.6	E318 N324 F326 F368	E318-K399 IonicContact OE1-NZ 2.78Å; E318-K399 PolarHBondContact OE1-NZ 2.84Å; E318-K399 IonicContact OE2-NZ 2.77Å; E318-K399 PolarHBondContact OE2-NZ 2.81Å; N324-K399 HydrophobicContact CB-CB 3.76Å; N324-K399 HydrophobicContact CB-CD 4.11Å; N324-K399 HydrophobicContact CB-CG 4.4Å; N324-K399 WeakPolarHBondContact O-CB 3.46Å; N324-K399 PolarHBondContact O-N 3.35Å; F326-K399 HydrophobicContact CD2-CB 4.07Å; F326-K399 HydrophobicContact CD2-CG 4.41Å; F326-K399 HydrophobicContact CE2-CB 3.98Å; F326-K399 HydrophobicContact CE2-CD 4.16Å; F326-K399 HydrophobicContact CE2-CG 3.81Å; F326-K399 HydrophobicContact CZ-CD 4.42Å; F368-K399 HydrophobicContact CD2-CD 4.42Å; F368-K399 HydrophobicContact CE2-CB 4.48Å; F368-K399 HydrophobicContact CE2-CD 3.6Å; F368-K399 HydrophobicContact CZ-CD 4.32Å
400	R	84.9	Confident	79	Confident	221 Å²	221	119.9 Å²	119.9	83%	0.834	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-63.5	130.5	174.3	-71.8	-174.1	-78.2	173.7	-4.3	109.1	L398 K402	L398-R400 PolarHBondContact O-N 3.34Å; R400-K402 PolarHBondContact O-N 3.3Å
401	P	75.9	Confident	78.5	Confident	63 Å²	63	122.9 Å²	122.9	41%	0.409	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-61.9	137.3	176.1	26.6	-34.3	0	0	0	109.3	D403 V404	P401-D403 PolarHBondContact O-N 2.76Å; P401-V404 HydrophobicContact CB-CG2 4.14Å; P401-V404 HydrophobicContact CG-CB 4.23Å; P401-V404 HydrophobicContact CG-CG2 3.84Å
402	K	68.2	Low	77.8	Confident	182 Å²	182	118.5 Å²	118.5	79%	0.791	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-20.1	-168.5	-160.3	173.5	179.6	-177.2	0	113.1	R400	R400-K402 PolarHBondContact O-N 3.3Å
403	D	58.9	Low	76.8	Confident	157 Å²	157	120.1 Å²	120.1	84%	0.84	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	10.5	-167.4	-58.5	-63.2	0	0	0	115.2	P401	P401-D403 PolarHBondContact O-N 2.76Å
404	V	57.6	Low	75.6	Confident	111 Å²	111	118.6 Å²	118.6	67%	0.673	57%	0.565	S	S	*	*			trans	-119.1	4.6	-174.8	-161.4	0	0	0	0	113.4	P401 R406	P401-V404 HydrophobicContact CB-CG2 4.14Å; P401-V404 HydrophobicContact CG-CB 4.23Å; P401-V404 HydrophobicContact CG-CG2 3.84Å; V404-R406 VanDerWaalsContact C-N 3.31Å; V404-R406 PolarHBondContact O-N 2.64Å
405	S	53.4	Low	74	Confident	102 Å²	102	126.9 Å²	126.9	71%	0.713	61%	0.605	S	S	*	*			trans	-87.5	18	-174.4	90.1	0	0	0	0	115.6
406	R	52.1	Low	72.2	Confident	222 Å²	222	129.5 Å²	129.5	84%	0.838	62%	0.62	S	S	*	*	S	Bend	trans	-117.5	116.2	172	-64.1	-173.4	-171.9	-166.3	2.6	108.8	V404	V404-R406 VanDerWaalsContact C-N 3.31Å; V404-R406 PolarHBondContact O-N 2.64Å
407	P	63.8	Low	70.1	Confident	129 Å²	129	140 Å²	140	84%	0.838	67%	0.67	S	S	*	*			trans	-60	138.1	160.9	28	-31.7	0	0	0	108.3
408	Y	44.5	Very low	67.8	Low	299 Å²	299	145.9 Å²	145.9	100%	1.173	70%	0.699	S	S	*	*			trans	-69.1	0	177.7	-108	-87	0	0	0	111.8

Retrieved 408 of 408 residues in 348.4 ms (Link to these results)

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