A0A077Z3G6_TRITR Loading...

Transmembrane serine protease 8

AlphaFold DB , UniProt , Accession A0A077Z3G6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 322 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	L	33.5	Very low	63.5	Low	223 Å²	223	96.2 Å²	96.2	100%	1.168	53%	0.531	S	S	*	.				0	90.7	0	-67	162.8	0	0	0	107.5	T3	L1-T3 PolarHBondContact O-N 3.11Å; L1-T3 VanDerWaalsContact O-N 3.11Å
2	T	30.8	Very low	66.1	Low	145 Å²	145	94.1 Å²	94.1	89%	0.89	54%	0.536	S	S	*	.			trans	-72	104.4	171.9	40.5	0	0	0	0	107.5	N4	T2-N4 PolarHBondContact O-N 3.49Å
3	T	37	Very low	68.3	Low	121 Å²	121	89.7 Å²	89.7	74%	0.742	51%	0.509	S	S	*	.			trans	-47	130.1	174	46.1	0	0	0	0	110.3	L1 A5	L1-T3 PolarHBondContact O-N 3.11Å; L1-T3 VanDerWaalsContact O-N 3.11Å; T3-A5 PolarHBondContact O-N 3.15Å
4	N	40.9	Very low	70	Confident	123 Å²	123	89.6 Å²	89.6	66%	0.658	51%	0.513	S	S	*	.			trans	-77.2	66.8	-176.5	-126.6	-16.9	0	0	0	109.8	T2 N6	T2-N4 PolarHBondContact O-N 3.49Å; N4-N6 PolarHBondContact O-N 2.81Å
5	A	43.1	Very low	71.4	Confident	79 Å²	79	85.1 Å²	85.1	65%	0.653	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	20	174.8	0	0	0	0	0	113.7	T3	T3-A5 PolarHBondContact O-N 3.15Å
6	N	52.6	Low	72.3	Confident	98 Å²	98	84.3 Å²	84.3	52%	0.524	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	9.9	-161.9	-97.8	-29	0	0	0	115.5	N4 R224	N4-N6 PolarHBondContact O-N 2.81Å; N6-R224 VanDerWaalsContact C-NH1 3.28Å; N6-R224 PolarHBondContact O-NH1 3.03Å; N6-R224 PolarHBondContact O-NH2 3.05Å; N6-R224 PolarHBondContact OD1-NH2 2.78Å
7	K	78.5	Confident	72.8	Confident	95 Å²	95	82.5 Å²	82.5	41%	0.413	47%	0.473	S	S	.	.			trans	-105.7	-17.5	-173.9	-65.6	-169.7	-175.9	-178.1	0	116.9	N66	K7-N66 PolarHBondContact NZ-OD1 3.14Å
8	C	95.1	Very high	72.7	Confident	25 Å²	25	82.9 Å²	82.9	17%	0.169	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	151.6	-179.7	70.1	0	0	0	0	112	R10 P145 C147 R224	C8-R10 PolarHBondContact O-N 3.41Å; C8-R10 VanDerWaalsContact O-N 3.12Å; C8-P145 WeakPolarHBondContact CA-O 3.24Å; C8-P145 HydrophobicContact CB-CG 4.11Å; C8-C147 HydrophobicContact CB-CB 4.02Å; C8-C147 WeakPolarHBondContact CB-SG 3.13Å; C8-C147 PolarHBondContact O-SG 3.17Å; C8-C147 WeakPolarHBondContact SG-CA 3.45Å; C8-C147 WeakPolarHBondContact SG-CB 3.27Å; C8-C147 CovalentContact SG-SG 2.05Å; C8-C147 PolarHBondContact SG-SG 2.82Å; C8-R224 PolarHBondContact O-NH1 3.2Å
9	G	96.2	Very high	72	Confident	1 Å²	1	80.2 Å²	80.2	1%	0.01	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	13.6	171	0	0	0	0	0	114.7	P145 R224 Y225	G9-P145 PolarHBondContact N-O 3.06Å; G9-R224 WeakPolarHBondContact O-CA 3.5Å; G9-Y225 VanDerWaalsContact CA-O 3.27Å; G9-Y225 WeakPolarHBondContact CA-O 3.49Å; G9-Y225 WeakPolarHBondContact O-CD2 3.21Å; G9-Y225 PolarHBondContact O-N 2.8Å
10	R	95.2	Very high	70.8	Confident	128 Å²	128	86.3 Å²	86.3	48%	0.483	48%	0.484	S	S	.	.			trans	-122.3	85.7	179	-71.1	-173.7	169.5	173.8	-0.2	110	C8 R224	C8-R10 PolarHBondContact O-N 3.41Å; C8-R10 VanDerWaalsContact O-N 3.12Å; R10-R224 HydrophobicContact CG-CG 3.97Å
11	P	95.4	Very high	69.8	Low	20 Å²	20	88.8 Å²	88.8	13%	0.13	49%	0.49	C	S	.	.			trans	-67.4	139.4	-179.5	29.9	-33.6	0	0	0	110.3	I13 P39 W40 Y225	P11-I13 PolarHBondContact O-N 2.7Å; P11-P39 HydrophobicContact CB-CG 3.77Å; P11-W40 HydrophobicContact CB-CZ3 4.15Å; P11-W40 HydrophobicContact CG-CH2 4.25Å; P11-W40 HydrophobicContact CG-CZ3 4.14Å; P11-Y225 HydrophobicContact CG-CD2 4.38Å; P11-Y225 HydrophobicContact CG-CE2 4.3Å
12	A	94.9	Very high	70.4	Confident	71 Å²	71	82.7 Å²	82.7	59%	0.587	47%	0.471	S	S	*	.	S	Bend	trans	-62.3	-27.4	175.9	0	0	0	0	0	112.3	K141	A12-K141 HydrophobicContact CB-CB 3.88Å
13	I	94.2	Very high	70.8	Confident	37 Å²	37	85.9 Å²	85.9	19%	0.19	47%	0.473	C	S	.	.	S	Bend	trans	-110.8	113.1	175.4	-61.4	171.6	0	0	0	107.4	P11 K34 H36 S37	P11-I13 PolarHBondContact O-N 2.7Å; I13-K34 HydrophobicContact CG2-CD 3.55Å; I13-K34 HydrophobicContact CG2-CG 4.04Å; I13-H36 HydrophobicContact CD1-CB 4.19Å; I13-S37 VanDerWaalsContact O-CA 3.31Å; I13-S37 WeakPolarHBondContact O-CA 3.35Å; I13-S37 WeakPolarHBondContact O-CB 3.37Å
14	P	92.3	Very high	70.9	Confident	88 Å²	88	83.3 Å²	83.3	57%	0.571	46%	0.464	S	S	*	.			trans	-61.1	136.4	-179.8	-25.7	34.3	0	0	0	112.1
15	P	91.7	Very high	70.7	Confident	23 Å²	23	80.7 Å²	80.7	15%	0.149	45%	0.45	C	S	.	.			trans	-69.8	157.2	175.2	30.3	-34.5	0	0	0	111.1	T17 L38 Y225	P15-T17 HydrophobicContact CG-CG2 4.26Å; P15-T17 PolarHBondContact O-N 3.3Å; P15-L38 HydrophobicContact CB-CD2 4.08Å; P15-Y225 HydrophobicContact CG-CE2 3.74Å; P15-Y225 VanDerWaalsContact CG-OH 3.32Å; P15-Y225 WeakPolarHBondContact CG-OH 3.4Å
16	I	86.2	Confident	70.4	Confident	72 Å²	72	87.3 Å²	87.3	37%	0.369	46%	0.458	S	S	.	.			trans	-75.7	114.8	166.3	-62.6	168.8	0	0	0	106.1	T18 W31 K34	I16-T18 WeakPolarHBondContact CG2-O 3.45Å; I16-W31 HydrophobicContact CG2-CG 4.49Å; I16-W31 VanDerWaalsContact O-CE2 3.31Å; I16-W31 WeakPolarHBondContact O-CZ2 3.39Å; I16-W31 PolarHBondContact O-NE1 3.1Å; I16-W31 VanDerWaalsContact O-NE1 3.08Å; I16-K34 HydrophobicContact CD1-CB 4.27Å; I16-K34 HydrophobicContact CG1-CB 4.32Å
17	T	80.5	Confident	69.6	Low	54 Å²	54	84.8 Å²	84.8	33%	0.331	44%	0.444	S	S	.	.			trans	-102.1	-12.5	178.2	54.6	0	0	0	0	113	P15 F162 Y225	P15-T17 HydrophobicContact CG-CG2 4.26Å; P15-T17 PolarHBondContact O-N 3.3Å; T17-F162 HydrophobicContact CG2-CE1 4.42Å; T17-F162 HydrophobicContact CG2-CE2 4.29Å; T17-F162 HydrophobicContact CG2-CZ 3.82Å; T17-Y225 WeakPolarHBondContact CG2-OH 3.45Å
18	T	71.3	Confident	67.9	Low	89 Å²	89	83.2 Å²	83.2	55%	0.546	44%	0.442	S	S	.	.	S	Bend	trans	-128.7	135.2	178.6	54	0	0	0	0	110	I16 K20	I16-T18 WeakPolarHBondContact CG2-O 3.45Å; T18-K20 PolarHBondContact O-N 2.81Å
19	S	58	Low	66.1	Low	31 Å²	31	82.9 Å²	82.9	22%	0.217	44%	0.441	C	S	.	.			trans	-71.2	97.3	166.5	-177.9	0	0	0	0	108.3	K21 A22	S19-K21 PolarHBondContact O-N 3.41Å; S19-K21 PolarHBondContact OG-N 2.81Å; S19-K21 PolarHBondContact OG-O 3.25Å; S19-A22 PolarHBondContact OG-N 3.44Å
20	K	49.7	Very low	65	Low	203 Å²	203	83.1 Å²	83.1	88%	0.883	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-10.8	168.6	-71.9	-171.2	177.5	-176	0	112.6	T18	T18-K20 PolarHBondContact O-N 2.81Å
21	K	48.1	Very low	64.4	Low	138 Å²	138	77.7 Å²	77.7	60%	0.6	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134	67.3	-179.2	-68.5	-177.8	176.4	-175.3	0	110.5	S19 K23 A24	S19-K21 PolarHBondContact O-N 3.41Å; S19-K21 PolarHBondContact OG-N 2.81Å; S19-K21 PolarHBondContact OG-O 3.25Å; K21-K23 PolarHBondContact O-N 3.33Å; K21-A24 HydrophobicContact CB-CB 4.18Å; K21-A24 HydrophobicContact CD-CB 4.13Å; K21-A24 PolarHBondContact O-N 3.07Å; K21-A24 VanDerWaalsContact O-N 3.09Å
22	A	46.7	Very low	64	Low	95 Å²	95	80.2 Å²	80.2	79%	0.785	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-19.3	169.7	0	0	0	0	0	113.6	S19	S19-A22 PolarHBondContact OG-N 3.44Å
23	K	39.2	Very low	63.8	Low	212 Å²	212	77 Å²	77	92%	0.922	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-5.4	179.5	-73.6	-174.1	175.4	-179.1	0	116.8	K21	K21-K23 PolarHBondContact O-N 3.33Å
24	A	40.1	Very low	63.7	Low	67 Å²	67	79.9 Å²	79.9	55%	0.554	42%	0.417	S	S	*	.			trans	-137.6	29	-171.6	0	0	0	0	0	115.2	K21 R26	K21-A24 HydrophobicContact CB-CB 4.18Å; K21-A24 HydrophobicContact CD-CB 4.13Å; K21-A24 PolarHBondContact O-N 3.07Å; K21-A24 VanDerWaalsContact O-N 3.09Å; A24-R26 PolarHBondContact O-N 2.82Å
25	N	36.6	Very low	63.8	Low	69 Å²	69	78.5 Å²	78.5	37%	0.369	41%	0.408	S	S	.	.			trans	-78.9	110.1	163.2	-78.5	-6.5	0	0	0	109	I27 G30	N25-I27 PolarHBondContact O-N 3.33Å; N25-G30 PolarHBondContact ND2-O 3.32Å; N25-G30 VanDerWaalsContact ND2-O 3.11Å
26	R	36.8	Very low	63.9	Low	218 Å²	218	78.9 Å²	78.9	82%	0.823	41%	0.408	S	S	*	.	S	Bend	trans	-67.8	5.3	171.4	-159.8	-172.7	77.7	111.8	-1.8	112.7	A24	A24-R26 PolarHBondContact O-N 2.82Å
27	I	34.6	Very low	64.3	Low	44 Å²	44	75.5 Å²	75.5	23%	0.226	39%	0.39	C	S	.	.	S	Bend	trans	-139.3	134.8	-165.8	-65.6	-171.2	0	0	0	108.6	N25	N25-I27 PolarHBondContact O-N 3.33Å
28	V	42.8	Very low	65.1	Low	62 Å²	62	73.2 Å²	73.2	38%	0.376	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	132.5	-162.3	-165.2	0	0	0	0	111	G30 K170 D206	V28-G30 PolarHBondContact O-N 2.84Å; V28-K170 HydrophobicContact CG2-CD 4.14Å; V28-D206 HydrophobicContact CB-CB 4.26Å; V28-D206 WeakPolarHBondContact CB-OD2 3.44Å; V28-D206 HydrophobicContact CG1-CB 3.36Å; V28-D206 VanDerWaalsContact CG1-CG 3.5Å; V28-D206 WeakPolarHBondContact CG1-OD2 3.24Å
29	S	57.7	Low	66.3	Low	19 Å²	19	69.2 Å²	69.2	13%	0.133	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	22.9	169.4	-60.1	0	0	0	0	118.5	T180 Y203 D206	S29-T180 WeakPolarHBondContact O-CB 3.12Å; S29-T180 PolarHBondContact O-OG1 3.07Å; S29-Y203 WeakPolarHBondContact O-CD2 3.21Å; S29-Y203 VanDerWaalsContact OG-CB 3.27Å; S29-Y203 WeakPolarHBondContact OG-CB 3.09Å; S29-D206 WeakPolarHBondContact CB-O 3.46Å; S29-D206 WeakPolarHBondContact OG-CB 3.1Å
30	G	73.2	Confident	68.2	Low	5 Å²	5	67.7 Å²	67.7	5%	0.052	34%	0.341	C	S	.	.	S	Bend	trans	-169.4	-166.1	174.7	0	0	0	0	0	111.1	N25 V28 S179	N25-G30 PolarHBondContact ND2-O 3.32Å; N25-G30 VanDerWaalsContact ND2-O 3.11Å; V28-G30 PolarHBondContact O-N 2.84Å; G30-S179 CarbonylContact C-O 3.57Å; G30-S179 WeakPolarHBondContact CA-O 3.43Å
31	W	83.1	Confident	70.5	Confident	14 Å²	14	58.3 Å²	58.3	5%	0.053	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	154.4	170.9	55.5	92.9	0	0	0	110.1	I16 A33 F162 R178 S179 V181 Y203	I16-W31 HydrophobicContact CG2-CG 4.49Å; I16-W31 VanDerWaalsContact O-CE2 3.31Å; I16-W31 WeakPolarHBondContact O-CZ2 3.39Å; I16-W31 PolarHBondContact O-NE1 3.1Å; I16-W31 VanDerWaalsContact O-NE1 3.08Å; W31-A33 PolarHBondContact O-N 3.02Å; W31-F162 HydrophobicContact CH2-CD1 4.44Å; W31-F162 HydrophobicContact CH2-CE1 4.34Å; W31-F162 HydrophobicContact CZ2-CD1 4.41Å; W31-F162 HydrophobicContact CZ2-CE1 4.4Å; W31-R178 CarbonylContact O-C 3.6Å; W31-R178 VanDerWaalsContact O-CA 3.29Å; W31-R178 WeakPolarHBondContact O-CA 3.49Å; W31-S179 PolarHBondContact N-O 2.82Å; W31-S179 PolarHBondContact O-N 2.84Å; W31-V181 HydrophobicContact CH2-CG2 3.49Å; W31-V181 VanDerWaalsContact CH2-CG2 3.49Å; W31-V181 HydrophobicContact CZ3-CG2 3.86Å; W31-Y203 HydrophobicContact CZ3-CE2 4.14Å
32	Q	86.8	Confident	72.9	Confident	74 Å²	74	51.7 Å²	51.7	35%	0.346	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	127.6	167.1	-169.4	-172	-60.1	0	0	108.2	H97 R176	Q32-H97 PolarHBondContact NE2-NE2 2.86Å; Q32-R176 HydrophobicContact CG-CB 4.14Å; Q32-R176 VanDerWaalsContact OE1-CD 3.3Å
33	A	90.4	Very high	75.3	Confident	4 Å²	4	47.7 Å²	47.7	3%	0.033	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-58.4	151.4	174	0	0	0	0	0	109.6	W31 L38 H97 L177	W31-A33 PolarHBondContact O-N 3.02Å; A33-L38 HydrophobicContact CB-CD1 4.04Å; A33-H97 PolarHBondContact O-CE1 3.12Å; A33-L177 HydrophobicContact CB-CB 4.28Å; A33-L177 HydrophobicContact CB-CD2 4.19Å; A33-L177 HydrophobicContact CB-CG 3.96Å; A33-L177 WeakPolarHBondContact CB-O 3.41Å; A33-L177 PolarHBondContact N-O 2.93Å
34	K	92.2	Very high	78.1	Confident	97 Å²	97	37.7 Å²	37.7	42%	0.422	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-66.7	133.5	167.4	179.5	177.6	177.1	-171.7	0	106.6	I13 I16 H36 S37	I13-K34 HydrophobicContact CG2-CD 3.55Å; I13-K34 HydrophobicContact CG2-CG 4.04Å; I16-K34 HydrophobicContact CD1-CB 4.27Å; I16-K34 HydrophobicContact CG1-CB 4.32Å; K34-H36 PolarHBondContact O-N 3.2Å; K34-S37 VanDerWaalsContact O-CB 3.32Å; K34-S37 WeakPolarHBondContact O-CB 3.4Å; K34-S37 PolarHBondContact O-N 2.62Å; K34-S37 PolarHBondContact O-OG 3.2Å
35	P	93.5	Very high	80.7	Confident	58 Å²	58	38.2 Å²	38.2	38%	0.377	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.2	128	-179.4	-30.1	35.1	0	0	0	112.4	S37 H97	P35-S37 PolarHBondContact O-N 3.24Å; P35-S37 VanDerWaalsContact O-N 3.15Å; P35-H97 WeakPolarHBondContact CA-ND1 3.14Å; P35-H97 HydrophobicContact CB-CB 4.27Å
36	H	94	Very high	83.5	Confident	32 Å²	32	35 Å²	35	15%	0.148	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	20.2	179.9	-34.6	-76.3	0	0	0	115.9	I13 K34 L38 G95 E103 S105 Y142	I13-H36 HydrophobicContact CD1-CB 4.19Å; K34-H36 PolarHBondContact O-N 3.2Å; H36-L38 VanDerWaalsContact C-N 3.25Å; H36-L38 PolarHBondContact O-N 3.27Å; H36-G95 PolarHBondContact ND1-O 2.7Å; H36-E103 IonicContact CE1-OE2 2.68Å; H36-E103 PolarHBondContact CE1-OE2 3.11Å; H36-S105 PolarHBondContact CE1-OG 2.89Å; H36-Y142 HydrophobicContact CB-CD1 3.66Å; H36-Y142 HydrophobicContact CB-CE1 4.47Å; H36-Y142 AromaticContact CD2-CD1 3.52Å; H36-Y142 AromaticContact CD2-CE1 3.58Å; H36-Y142 AromaticContact CG-CD1 3.36Å; H36-Y142 AromaticContact CG-CE1 3.93Å; H36-Y142 AromaticContact ND1-CD1 3.75Å; H36-Y142 AromaticContact NE2-CE1 3.91Å
37	S	95.3	Very high	86.2	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.007	15%	0.148	C	C	.	.	S	Bend	trans	-79.1	-8	173.9	72.4	0	0	0	0	114.3	I13 K34 P35 P39	I13-S37 VanDerWaalsContact O-CA 3.31Å; I13-S37 WeakPolarHBondContact O-CA 3.35Å; I13-S37 WeakPolarHBondContact O-CB 3.37Å; K34-S37 VanDerWaalsContact O-CB 3.32Å; K34-S37 WeakPolarHBondContact O-CB 3.4Å; K34-S37 PolarHBondContact O-N 2.62Å; K34-S37 PolarHBondContact O-OG 3.2Å; P35-S37 PolarHBondContact O-N 3.24Å; P35-S37 VanDerWaalsContact O-N 3.15Å; S37-P39 WeakPolarHBondContact O-CD 3.5Å
38	L	96.9	Very high	88.8	Confident	6 Å²	6	27.7 Å²	27.7	3%	0.031	15%	0.145	C	C	.	.	S	Bend	trans	-124.3	65.3	177.9	-57.8	177.2	0	0	0	109.2	P15 A33 H36 W40 M41 A164 L177 F218	P15-L38 HydrophobicContact CB-CD2 4.08Å; A33-L38 HydrophobicContact CB-CD1 4.04Å; H36-L38 VanDerWaalsContact C-N 3.25Å; H36-L38 PolarHBondContact O-N 3.27Å; L38-W40 HydrophobicContact CB-CZ2 4.48Å; L38-W40 HydrophobicContact CD2-CH2 4.19Å; L38-W40 HydrophobicContact CD2-CZ2 3.59Å; L38-W40 PolarHBondContact O-N 3.15Å; L38-W40 VanDerWaalsContact O-N 3.1Å; L38-M41 HydrophobicContact CB-CG 3.8Å; L38-M41 WeakPolarHBondContact O-CB 3.44Å; L38-M41 WeakPolarHBondContact O-CG 3.4Å; L38-M41 PolarHBondContact O-N 3.43Å; L38-M41 VanDerWaalsContact O-N 3.15Å; L38-A164 HydrophobicContact CD1-CB 3.5Å; L38-A164 VanDerWaalsContact CD1-CB 3.5Å; L38-L177 HydrophobicContact CB-CD2 3.92Å; L38-L177 HydrophobicContact CD1-CD2 3.94Å; L38-L177 HydrophobicContact CD1-CG 4.28Å; L38-L177 HydrophobicContact CG-CD2 4.39Å; L38-F218 HydrophobicContact CD1-CZ 4.28Å; L38-F218 HydrophobicContact CD2-CE2 3.85Å; L38-F218 HydrophobicContact CD2-CZ 3.57Å
39	P	97	Very high	91	Very high	4 Å²	4	27.6 Å²	27.6	3%	0.026	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-2.9	-167.2	33.4	-41.4	0	0	0	114.7	P11 S37 Y142 V143 S144	P11-P39 HydrophobicContact CB-CG 3.77Å; S37-P39 WeakPolarHBondContact O-CD 3.5Å; P39-Y142 WeakPolarHBondContact CA-O 3.38Å; P39-Y142 VanDerWaalsContact CB-O 3.25Å; P39-Y142 WeakPolarHBondContact CB-O 3.39Å; P39-V143 WeakPolarHBondContact O-CA 3.04Å; P39-S144 CarbonylContact C-O 3.52Å; P39-S144 VanDerWaalsContact C-O 3.25Å; P39-S144 WeakPolarHBondContact CG-OG 3.48Å; P39-S144 PolarHBondContact O-N 2.9Å
40	W	98.2	Very high	92.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-11.9	173.8	48.4	81.1	0	0	0	112.9	P11 L38 V42 S58 L59 S144 I146 F218 Y225	P11-W40 HydrophobicContact CB-CZ3 4.15Å; P11-W40 HydrophobicContact CG-CH2 4.25Å; P11-W40 HydrophobicContact CG-CZ3 4.14Å; L38-W40 HydrophobicContact CB-CZ2 4.48Å; L38-W40 HydrophobicContact CD2-CH2 4.19Å; L38-W40 HydrophobicContact CD2-CZ2 3.59Å; L38-W40 PolarHBondContact O-N 3.15Å; L38-W40 VanDerWaalsContact O-N 3.1Å; W40-V42 PolarHBondContact O-N 3.17Å; W40-S58 CarbonylContact O-C 3.58Å; W40-S58 VanDerWaalsContact O-CA 3.29Å; W40-S58 WeakPolarHBondContact O-CA 3.27Å; W40-L59 PolarHBondContact O-N 3.39Å; W40-S144 WeakPolarHBondContact CA-O 3.07Å; W40-S144 WeakPolarHBondContact CB-O 3.34Å; W40-S144 PolarHBondContact N-O 2.91Å; W40-S144 VanDerWaalsContact N-O 3.16Å; W40-I146 HydrophobicContact CB-CB 3.87Å; W40-I146 HydrophobicContact CB-CG2 4.29Å; W40-I146 HydrophobicContact CD2-CB 3.92Å; W40-I146 HydrophobicContact CD2-CD1 4.31Å; W40-I146 HydrophobicContact CD2-CG1 4.34Å; W40-I146 HydrophobicContact CE3-CB 4.28Å; W40-I146 HydrophobicContact CG-CB 3.73Å; W40-I146 HydrophobicContact CG-CD1 4.46Å; W40-I146 HydrophobicContact CG-CG2 4.38Å; W40-I146 HydrophobicContact CZ2-CD1 4.47Å; W40-F218 AromaticContact CZ2-CD2 3.83Å; W40-F218 HydrophobicContact CZ2-CD2 3.83Å; W40-F218 AromaticContact CZ2-CE2 3.78Å; W40-F218 HydrophobicContact CZ2-CE2 3.78Å; W40-F218 HydrophobicContact CZ2-CG 4.35Å; W40-F218 HydrophobicContact CZ2-CZ 4.27Å; W40-Y225 AromaticContact CH2-CD2 3.66Å; W40-Y225 HydrophobicContact CH2-CD2 3.66Å; W40-Y225 HydrophobicContact CH2-CE2 4.48Å; W40-Y225 AromaticContact CH2-CG 3.83Å; W40-Y225 HydrophobicContact CH2-CG 3.83Å; W40-Y225 HydrophobicContact CZ2-CG 4.37Å; W40-Y225 HydrophobicContact CZ3-CD2 4.33Å
41	M	98	Very high	92.9	Very high	5 Å²	5	40.6 Å²	40.6	3%	0.025	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	135.4	-176.7	-68.8	-63.9	-55.8	0	0	111.1	L38 A56 A164 W166 L177 P216	L38-M41 HydrophobicContact CB-CG 3.8Å; L38-M41 WeakPolarHBondContact O-CB 3.44Å; L38-M41 WeakPolarHBondContact O-CG 3.4Å; L38-M41 PolarHBondContact O-N 3.43Å; L38-M41 VanDerWaalsContact O-N 3.15Å; M41-A56 HydrophobicContact CE-CB 4.21Å; M41-A164 WeakPolarHBondContact CE-O 3.42Å; M41-A164 HydrophobicContact SD-CB 4.13Å; M41-W166 HydrophobicContact CB-CH2 3.51Å; M41-W166 HydrophobicContact CB-CZ2 4.38Å; M41-W166 HydrophobicContact CB-CZ3 4.01Å; M41-W166 HydrophobicContact CE-CE3 4.13Å; M41-W166 HydrophobicContact CE-CH2 4.17Å; M41-W166 HydrophobicContact CE-CZ3 3.57Å; M41-W166 HydrophobicContact CG-CH2 4.46Å; M41-L177 HydrophobicContact CB-CD2 4.38Å; M41-L177 HydrophobicContact CE-CD1 3.98Å; M41-L177 HydrophobicContact CG-CD1 4.15Å; M41-L177 HydrophobicContact CG-CD2 3.98Å; M41-P216 VanDerWaalsContact SD-CD 3.53Å; M41-P216 HydrophobicContact SD-CG 3.49Å; M41-P216 WeakPolarHBondContact SD-CG 3.45Å
42	V	98.3	Very high	93.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	130.2	174.4	-172.5	0	0	0	0	107.8	W40 L44 A56 G57 L59 V71 A92 V94	W40-V42 PolarHBondContact O-N 3.17Å; V42-L44 HydrophobicContact CG1-CD2 3.82Å; V42-L44 HydrophobicContact CG1-CG 4.36Å; V42-A56 CarbonylContact O-C 3.57Å; V42-A56 VanDerWaalsContact O-CA 3.24Å; V42-A56 WeakPolarHBondContact O-CA 3.19Å; V42-G57 PolarHBondContact N-O 3.49Å; V42-G57 PolarHBondContact O-N 3.38Å; V42-L59 HydrophobicContact CG2-CD2 4.14Å; V42-L59 HydrophobicContact CG2-CG 3.72Å; V42-V71 HydrophobicContact CB-CG1 4.06Å; V42-V71 HydrophobicContact CG1-CG1 4.2Å; V42-V71 HydrophobicContact CG1-CG2 4.28Å; V42-V71 HydrophobicContact CG2-CG1 3.86Å; V42-V71 HydrophobicContact CG2-CG2 3.93Å; V42-A92 HydrophobicContact CG1-CB 3.84Å; V42-V94 HydrophobicContact CG1-CG1 4.22Å; V42-V94 HydrophobicContact CG2-CG1 4.09Å
43	Y	97.1	Very high	93.3	Very high	11 Å²	11	42 Å²	42	4%	0.043	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.9	168.7	-178	-100.2	0	0	0	108.4	E45 L54 I93 V99 W166	Y43-E45 HydrophobicContact CD1-CG 3.95Å; Y43-E45 HydrophobicContact CE1-CG 3.4Å; Y43-E45 VanDerWaalsContact CE1-CG 3.4Å; Y43-E45 WeakPolarHBondContact CE1-OE1 3.44Å; Y43-L54 HydrophobicContact CE1-CD2 4.36Å; Y43-L54 WeakPolarHBondContact OH-CD1 3.35Å; Y43-L54 WeakPolarHBondContact OH-CD2 3.49Å; Y43-I93 HydrophobicContact CD1-CD1 3.82Å; Y43-I93 HydrophobicContact CD1-CG1 4.29Å; Y43-I93 HydrophobicContact CE1-CD1 4.36Å; Y43-I93 PolarHBondContact N-O 2.91Å; Y43-I93 PolarHBondContact O-N 2.84Å; Y43-V99 HydrophobicContact CD1-CG1 4.33Å; Y43-V99 HydrophobicContact CD2-CG1 4.09Å; Y43-V99 HydrophobicContact CD2-CG2 4.47Å; Y43-V99 HydrophobicContact CE2-CG2 4.11Å; Y43-V99 HydrophobicContact CG-CG1 3.97Å; Y43-W166 HydrophobicContact CD2-CB 4.21Å; Y43-W166 HydrophobicContact CD2-CD2 4.03Å; Y43-W166 AromaticContact CD2-CE3 3.86Å; Y43-W166 HydrophobicContact CD2-CE3 3.86Å; Y43-W166 HydrophobicContact CD2-CG 4.22Å; Y43-W166 HydrophobicContact CD2-CZ3 4.44Å; Y43-W166 HydrophobicContact CE2-CB 4.2Å
44	L	97.3	Very high	93.4	Very high	1 Å²	1	45 Å²	45	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.3	-177.9	-61.4	174.3	0	0	0	109.3	V42 I46 C55 T73 I90 T91 A92 L131	V42-L44 HydrophobicContact CG1-CD2 3.82Å; V42-L44 HydrophobicContact CG1-CG 4.36Å; L44-I46 HydrophobicContact CB-CD1 3.8Å; L44-C55 HydrophobicContact CB-CB 4.03Å; L44-C55 HydrophobicContact CD1-CB 4.19Å; L44-C55 PolarHBondContact N-O 3.38Å; L44-C55 PolarHBondContact O-N 3.14Å; L44-T73 HydrophobicContact CD1-CG2 3.94Å; L44-I90 HydrophobicContact CD2-CG2 4.42Å; L44-T91 WeakPolarHBondContact CA-O 3.41Å; L44-A92 HydrophobicContact CD2-CB 3.85Å; L44-L131 HydrophobicContact CD1-CD1 4.01Å; L44-L131 HydrophobicContact CD2-CD1 3.84Å
45	E	95.1	Very high	93.6	Very high	79 Å²	79	40.6 Å²	40.6	37%	0.369	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122	167	-63.8	-175	167.9	0	0	107.9	Y43 L54 T91	Y43-E45 HydrophobicContact CD1-CG 3.95Å; Y43-E45 HydrophobicContact CE1-CG 3.4Å; Y43-E45 VanDerWaalsContact CE1-CG 3.4Å; Y43-E45 WeakPolarHBondContact CE1-OE1 3.44Å; E45-L54 HydrophobicContact CG-CD2 4.18Å; E45-T91 PolarHBondContact N-O 2.85Å; E45-T91 PolarHBondContact O-N 2.91Å
46	I	95.3	Very high	93.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	110.4	-178.8	-55.8	96.7	0	0	0	108.7	L44 V48 A52 L53 C55 L85 N89 I90	L44-I46 HydrophobicContact CB-CD1 3.8Å; I46-V48 HydrophobicContact CG2-CG1 4.23Å; I46-V48 PolarHBondContact O-N 3.12Å; I46-A52 CarbonylContact O-C 3.42Å; I46-A52 VanDerWaalsContact O-CA 3.28Å; I46-A52 WeakPolarHBondContact O-CA 3.45Å; I46-L53 HydrophobicContact CB-CB 4.26Å; I46-L53 WeakPolarHBondContact CD1-O 3.46Å; I46-L53 PolarHBondContact N-O 3.3Å; I46-L53 PolarHBondContact O-N 3.35Å; I46-C55 HydrophobicContact CD1-CB 3.9Å; I46-L85 HydrophobicContact CG2-CD1 3.35Å; I46-N89 CarbonylContact C-O 3.55Å; I46-N89 WeakPolarHBondContact CA-O 3.49Å; I46-I90 HydrophobicContact CG1-CG1 4.36Å; I46-I90 HydrophobicContact CG1-CG2 4.24Å; I46-I90 HydrophobicContact CG2-CG1 4.31Å
47	D	93.8	Very high	93.9	Very high	80 Å²	80	36.3 Å²	36.3	43%	0.428	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	117.4	174.9	-175.4	-4	0	0	0	110	G49 N89	D47-G49 WeakPolarHBondContact OD1-CA 3.33Å; D47-G49 PolarHBondContact OD1-N 2.05Å; D47-N89 HydrophobicContact CB-CB 4.27Å; D47-N89 PolarHBondContact N-O 3.48Å; D47-N89 WeakPolarHBondContact O-CB 3.35Å; D47-N89 PolarHBondContact O-ND2 3.24Å
48	V	90	Very high	94.1	Very high	30 Å²	30	36.3 Å²	36.3	18%	0.182	21%	0.21	C	C	.	.			trans	-117.2	22.7	173.1	-61.3	0	0	0	0	112.3	I46 V51 L53 H80 L85	I46-V48 HydrophobicContact CG2-CG1 4.23Å; I46-V48 PolarHBondContact O-N 3.12Å; V48-V51 HydrophobicContact CG2-CG2 3.83Å; V48-V51 WeakPolarHBondContact CG2-O 3.43Å; V48-V51 PolarHBondContact N-O 2.86Å; V48-L53 HydrophobicContact CG1-CD1 3.68Å; V48-L53 HydrophobicContact CG1-CG 3.86Å; V48-L53 HydrophobicContact CG2-CD1 4.39Å; V48-L53 HydrophobicContact CG2-CD2 4.48Å; V48-L53 HydrophobicContact CG2-CG 3.85Å; V48-H80 HydrophobicContact CG1-CB 4.12Å; V48-L85 HydrophobicContact CG1-CD1 3.57Å; V48-L85 HydrophobicContact CG1-CD2 4.28Å
49	G	87.5	Confident	94.2	Very high	59 Å²	59	36 Å²	36	61%	0.608	21%	0.209	S	C	*	.	S	Bend	trans	107.5	-106.9	178.8	0	0	0	0	0	112.1	D47 V51	D47-G49 WeakPolarHBondContact OD1-CA 3.33Å; D47-G49 PolarHBondContact OD1-N 2.05Å; G49-V51 PolarHBondContact O-N 3.15Å
50	E	84.9	Confident	94.2	Very high	201 Å²	201	35.8 Å²	35.8	94%	0.939	21%	0.208	S	C	*	.	S	Bend	trans	-71.3	-18.3	-175.7	-64.7	-175.1	174.7	0	0	113.6
51	V	86.8	Confident	94	Very high	97 Å²	97	38.5 Å²	38.5	59%	0.588	22%	0.222	S	C	*	.	S	Bend	trans	-137.7	156.6	-178.7	-61.2	0	0	0	0	110.2	V48 G49	V48-V51 HydrophobicContact CG2-CG2 3.83Å; V48-V51 WeakPolarHBondContact CG2-O 3.43Å; V48-V51 PolarHBondContact N-O 2.86Å; G49-V51 PolarHBondContact O-N 3.15Å
52	A	88.3	Confident	93.8	Very high	57 Å²	57	38.8 Å²	38.8	47%	0.471	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	133.7	168.1	0	0	0	0	0	110.2	I46	I46-A52 CarbonylContact O-C 3.42Å; I46-A52 VanDerWaalsContact O-CA 3.28Å; I46-A52 WeakPolarHBondContact O-CA 3.45Å
53	L	90.1	Very high	93.4	Very high	59 Å²	59	41.8 Å²	41.8	31%	0.309	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	138.3	162.2	-64.2	177.9	0	0	0	108.7	I46 V48	I46-L53 HydrophobicContact CB-CB 4.26Å; I46-L53 WeakPolarHBondContact CD1-O 3.46Å; I46-L53 PolarHBondContact N-O 3.3Å; I46-L53 PolarHBondContact O-N 3.35Å; V48-L53 HydrophobicContact CG1-CD1 3.68Å; V48-L53 HydrophobicContact CG1-CG 3.86Å; V48-L53 HydrophobicContact CG2-CD1 4.39Å; V48-L53 HydrophobicContact CG2-CD2 4.48Å; V48-L53 HydrophobicContact CG2-CG 3.85Å
54	L	92.6	Very high	93.2	Very high	67 Å²	67	44.3 Å²	44.3	35%	0.351	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.5	176.9	-57.7	-178.3	0	0	0	109.3	Y43 E45 G211	Y43-L54 HydrophobicContact CE1-CD2 4.36Å; Y43-L54 WeakPolarHBondContact OH-CD1 3.35Å; Y43-L54 WeakPolarHBondContact OH-CD2 3.49Å; E45-L54 HydrophobicContact CG-CD2 4.18Å; L54-G211 WeakPolarHBondContact O-CA 3.26Å
55	C	95.5	Very high	92.9	Very high	5 Å²	5	52.9 Å²	52.9	3%	0.034	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	172.5	172.5	-82.8	0	0	0	0	110.6	L44 I46 C77 S213	L44-C55 HydrophobicContact CB-CB 4.03Å; L44-C55 HydrophobicContact CD1-CB 4.19Å; L44-C55 PolarHBondContact N-O 3.38Å; L44-C55 PolarHBondContact O-N 3.14Å; I46-C55 HydrophobicContact CD1-CB 3.9Å; C55-C77 HydrophobicContact CB-CB 3.77Å; C55-C77 WeakPolarHBondContact CB-SG 3.5Å; C55-C77 WeakPolarHBondContact SG-CB 3.32Å; C55-C77 CovalentContact SG-SG 2.04Å; C55-C77 PolarHBondContact SG-SG 3.39Å; C55-S213 WeakPolarHBondContact CB-O 3.12Å; C55-S213 VanDerWaalsContact SG-CB 3.59Å
56	A	96.4	Very high	92.8	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	165.1	168	0	0	0	0	0	110.6	M41 V42 T73 S213 G214	M41-A56 HydrophobicContact CE-CB 4.21Å; V42-A56 CarbonylContact O-C 3.57Å; V42-A56 VanDerWaalsContact O-CA 3.24Å; V42-A56 WeakPolarHBondContact O-CA 3.19Å; A56-T73 PolarHBondContact O-OG1 3.43Å; A56-S213 PolarHBondContact N-O 3.03Å; A56-G214 CarbonylContact O-C 3.58Å; A56-G214 VanDerWaalsContact O-C 3.3Å; A56-G214 WeakPolarHBondContact O-CA 3.38Å
57	G	98.3	Very high	92.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	179.1	171.7	0	0	0	0	0	111.1	V42 V72	V42-G57 PolarHBondContact N-O 3.49Å; V42-G57 PolarHBondContact O-N 3.38Å; G57-V72 CarbonylContact C-O 3.57Å; G57-V72 VanDerWaalsContact CA-O 3.3Å; G57-V72 WeakPolarHBondContact CA-O 3.01Å
58	S	98.8	Very high	93	Very high	1 Å²	1	50 Å²	50	1%	0.007	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	130.7	175.9	-64.5	0	0	0	0	111.6	W40 V60 V71 V72 P216	W40-S58 CarbonylContact O-C 3.58Å; W40-S58 VanDerWaalsContact O-CA 3.29Å; W40-S58 WeakPolarHBondContact O-CA 3.27Å; S58-V60 PolarHBondContact O-N 3.48Å; S58-V71 CarbonylContact O-C 3.5Å; S58-V71 WeakPolarHBondContact O-CA 3.37Å; S58-V72 PolarHBondContact N-O 3.07Å; S58-V72 PolarHBondContact O-N 3.17Å; S58-P216 WeakPolarHBondContact OG-CB 3.44Å
59	L	98.6	Very high	93.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	129.2	167.9	-69.1	167.6	0	0	0	109.7	W40 V42 T68 I70 V71 V94 L133 V137 V143 P145 I146	W40-L59 PolarHBondContact O-N 3.39Å; V42-L59 HydrophobicContact CG2-CD2 4.14Å; V42-L59 HydrophobicContact CG2-CG 3.72Å; L59-T68 HydrophobicContact CB-CG2 4.19Å; L59-T68 HydrophobicContact CD2-CG2 3.86Å; L59-I70 WeakPolarHBondContact CA-O 3.19Å; L59-V71 HydrophobicContact CD2-CG2 3.91Å; L59-V94 HydrophobicContact CD1-CB 4.45Å; L59-V94 HydrophobicContact CD1-CG1 4.1Å; L59-V94 HydrophobicContact CD2-CG1 4.28Å; L59-V94 HydrophobicContact CG-CG1 4.43Å; L59-L133 HydrophobicContact CD2-CD1 4.18Å; L59-V137 HydrophobicContact CD1-CG2 4.03Å; L59-V137 HydrophobicContact CD2-CG2 3.79Å; L59-V143 HydrophobicContact CD1-CG1 3.51Å; L59-P145 HydrophobicContact CB-CB 4.48Å; L59-P145 CarbonylContact O-C 3.46Å; L59-P145 VanDerWaalsContact O-CA 3.26Å; L59-P145 WeakPolarHBondContact O-CA 3.42Å; L59-P145 WeakPolarHBondContact O-CB 3.29Å; L59-I146 WeakPolarHBondContact O-CG2 3.48Å; L59-I146 PolarHBondContact O-N 2.84Å
60	V	97.9	Very high	93.9	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	148.5	175	-65.8	0	0	0	0	109.9	S58 T68 I70 V72 I146 L148 L227	S58-V60 PolarHBondContact O-N 3.48Å; V60-T68 WeakPolarHBondContact O-CB 3.4Å; V60-T68 PolarHBondContact O-OG1 2.85Å; V60-I70 HydrophobicContact CG2-CB 3.94Å; V60-I70 HydrophobicContact CG2-CG2 3.45Å; V60-I70 VanDerWaalsContact CG2-CG2 3.45Å; V60-I70 PolarHBondContact N-O 3.38Å; V60-I70 VanDerWaalsContact N-O 3.08Å; V60-V72 HydrophobicContact CG1-CB 4.5Å; V60-V72 HydrophobicContact CG1-CG1 3.65Å; V60-I146 HydrophobicContact CG1-CG2 4.15Å; V60-L148 HydrophobicContact CB-CD2 4.34Å; V60-L148 HydrophobicContact CB-CG 4.3Å; V60-L148 HydrophobicContact CG1-CD2 3.78Å; V60-L148 HydrophobicContact CG1-CG 4.18Å; V60-L227 HydrophobicContact CG1-CD2 4.44Å
61	D	94.3	Very high	94.6	Very high	57 Å²	57	36.5 Å²	36.5	31%	0.305	21%	0.212	S	C	.	.			trans	-71.5	136.1	179.1	-168.4	73.7	0	0	0	110.6	G63 Y139 P145	D61-G63 PolarHBondContact OD2-N 2.96Å; D61-Y139 PolarHBondContact OD1-OH 3.28Å; D61-P145 HydrophobicContact CB-CB 4.27Å; D61-P145 HydrophobicContact CB-CG 4.06Å
62	N	92.4	Very high	95.1	Very high	11 Å²	11	31.9 Å²	31.9	6%	0.059	19%	0.185	C	C	.	.			trans	-118.1	11	-179.2	71.7	-9.5	0	0	0	112.6	M64 D69 I70 I262	N62-M64 PolarHBondContact ND2-SD 3.1Å; N62-M64 WeakPolarHBondContact OD1-CB 3.15Å; N62-M64 WeakPolarHBondContact OD1-CG 3.48Å; N62-M64 PolarHBondContact OD1-N 3.49Å; N62-D69 PolarHBondContact ND2-OD1 3.48Å; N62-I70 HydrophobicContact CB-CB 4.43Å; N62-I70 HydrophobicContact CB-CG1 3.61Å; N62-I262 HydrophobicContact CB-CG2 3.9Å
63	G	89.8	Confident	95.6	Very high	62 Å²	62	29.2 Å²	29.2	64%	0.639	16%	0.162	S	C	*	.	S	Bend	trans	83.2	2.2	-178.2	0	0	0	0	0	115.9	D61	D61-G63 PolarHBondContact OD2-N 2.96Å
64	M	92.9	Very high	95.9	Very high	64 Å²	64	26.4 Å²	26.4	32%	0.315	15%	0.147	S	C	.	.			trans	-68.9	148.9	171.4	-65.7	177.9	100	0	0	111.2	N62 N66 Q67 P136	N62-M64 PolarHBondContact ND2-SD 3.1Å; N62-M64 WeakPolarHBondContact OD1-CB 3.15Å; N62-M64 WeakPolarHBondContact OD1-CG 3.48Å; N62-M64 PolarHBondContact OD1-N 3.49Å; M64-N66 PolarHBondContact O-N 3.25Å; M64-N66 VanDerWaalsContact O-N 3.15Å; M64-Q67 HydrophobicContact CB-CG 3.67Å; M64-Q67 WeakPolarHBondContact CB-O 3.34Å; M64-Q67 HydrophobicContact CE-CG 4.42Å; M64-Q67 HydrophobicContact SD-CG 4.2Å; M64-P136 HydrophobicContact CE-CB 4.31Å; M64-P136 HydrophobicContact CE-CG 3.8Å; M64-P136 HydrophobicContact SD-CB 4.26Å; M64-P136 HydrophobicContact SD-CG 4.24Å
65	E	91.9	Very high	96	Very high	181 Å²	181	23.2 Å²	23.2	85%	0.846	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	110.9	-179.8	-174.8	171.8	-165.8	0	0	111	Q67	E65-Q67 PolarHBondContact O-N 3.23Å
66	N	93.8	Very high	95.8	Very high	59 Å²	59	24.8 Å²	24.8	32%	0.316	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	24.2	173.7	-159.3	68.9	0	0	0	115.3	K7 M64 Q138 Y139	K7-N66 PolarHBondContact NZ-OD1 3.14Å; M64-N66 PolarHBondContact O-N 3.25Å; M64-N66 VanDerWaalsContact O-N 3.15Å; N66-Q138 PolarHBondContact O-OE1 2.02Å; N66-Y139 VanDerWaalsContact C-CD2 3.47Å; N66-Y139 WeakPolarHBondContact O-CB 3.49Å; N66-Y139 PolarHBondContact O-N 2.89Å
67	Q	96	Very high	95.7	Very high	41 Å²	41	24.9 Å²	24.9	19%	0.192	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	164.9	177.9	64.1	-171.2	54.9	0	0	110.3	M64 E65 P136 V137 Y139	M64-Q67 HydrophobicContact CB-CG 3.67Å; M64-Q67 WeakPolarHBondContact CB-O 3.34Å; M64-Q67 HydrophobicContact CE-CG 4.42Å; M64-Q67 HydrophobicContact SD-CG 4.2Å; E65-Q67 PolarHBondContact O-N 3.23Å; Q67-P136 HydrophobicContact CB-CB 4.23Å; Q67-P136 HydrophobicContact CG-CB 4.06Å; Q67-P136 VanDerWaalsContact NE2-CB 3.27Å; Q67-V137 CarbonylContact C-O 3.57Å; Q67-V137 WeakPolarHBondContact CA-O 3.31Å; Q67-V137 VanDerWaalsContact CB-O 3.24Å; Q67-V137 WeakPolarHBondContact CB-O 3.48Å; Q67-Y139 VanDerWaalsContact C-CZ 3.43Å; Q67-Y139 PolarHBondContact O-OH 2.57Å; Q67-Y139 VanDerWaalsContact O-OH 3.11Å
68	T	96.9	Very high	95.5	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	154.6	168.2	-171.9	0	0	0	0	110.1	L59 V60 I70 P136 V137 Y139	L59-T68 HydrophobicContact CB-CG2 4.19Å; L59-T68 HydrophobicContact CD2-CG2 3.86Å; V60-T68 WeakPolarHBondContact O-CB 3.4Å; V60-T68 PolarHBondContact O-OG1 2.85Å; T68-I70 PolarHBondContact OG1-N 3.42Å; T68-I70 VanDerWaalsContact OG1-N 3.16Å; T68-P136 CarbonylContact O-C 3.33Å; T68-P136 WeakPolarHBondContact O-CA 3.44Å; T68-V137 HydrophobicContact CG2-CG2 4.01Å; T68-V137 PolarHBondContact N-O 3.36Å; T68-V137 VanDerWaalsContact N-O 3.07Å; T68-V137 VanDerWaalsContact O-CG2 3.26Å; T68-V137 WeakPolarHBondContact O-CG2 3.45Å; T68-V137 PolarHBondContact O-N 3.15Å; T68-Y139 WeakPolarHBondContact CB-OH 3.23Å; T68-Y139 HydrophobicContact CG2-CE1 3.83Å
69	D	97.7	Very high	95.2	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.021	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	11.3	169.4	63.3	-0.2	0	0	0	111.8	N62 R132 L133 P136	N62-D69 PolarHBondContact ND2-OD1 3.48Å; D69-R132 HydrophobicContact CB-CG 4.37Å; D69-R132 CarbonylContact O-C 3.57Å; D69-R132 VanDerWaalsContact O-CA 3.31Å; D69-R132 WeakPolarHBondContact O-CA 3.49Å; D69-R132 IonicContact OD2-CZ 3.14Å; D69-R132 IonicContact OD2-NE 3.44Å; D69-R132 PolarHBondContact OD2-NE 2.96Å; D69-R132 IonicContact OD2-NH2 3.27Å; D69-R132 PolarHBondContact OD2-NH2 2.84Å; D69-L133 HydrophobicContact CB-CB 4.36Å; D69-L133 WeakPolarHBondContact O-CG 3.32Å; D69-L133 PolarHBondContact O-N 2.97Å; D69-P136 HydrophobicContact CB-CB 4.28Å; D69-P136 HydrophobicContact CB-CG 4.35Å
70	I	98.3	Very high	94.6	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	126.8	-172.9	-54.3	-59.9	0	0	0	112.1	L59 V60 N62 T68 L130 L131 R132 I262 L265	L59-I70 WeakPolarHBondContact CA-O 3.19Å; V60-I70 HydrophobicContact CG2-CB 3.94Å; V60-I70 HydrophobicContact CG2-CG2 3.45Å; V60-I70 VanDerWaalsContact CG2-CG2 3.45Å; V60-I70 PolarHBondContact N-O 3.38Å; V60-I70 VanDerWaalsContact N-O 3.08Å; N62-I70 HydrophobicContact CB-CB 4.43Å; N62-I70 HydrophobicContact CB-CG1 3.61Å; T68-I70 PolarHBondContact OG1-N 3.42Å; T68-I70 VanDerWaalsContact OG1-N 3.16Å; I70-L130 HydrophobicContact CG2-CD2 4.47Å; I70-L131 WeakPolarHBondContact CA-O 3.26Å; I70-R132 HydrophobicContact CD1-CB 4.21Å; I70-R132 HydrophobicContact CD1-CG 4.16Å; I70-I262 HydrophobicContact CG1-CG1 4.21Å; I70-I262 HydrophobicContact CG1-CG2 4.39Å; I70-I262 HydrophobicContact CG2-CD1 4.36Å; I70-I262 HydrophobicContact CG2-CG1 4.16Å; I70-L265 HydrophobicContact CD1-CD1 4.26Å
71	V	98.8	Very high	94	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.2	169.6	-177.2	0	0	0	0	109.2	V42 S58 L59 L130 L131 L133	V42-V71 HydrophobicContact CB-CG1 4.06Å; V42-V71 HydrophobicContact CG1-CG1 4.2Å; V42-V71 HydrophobicContact CG1-CG2 4.28Å; V42-V71 HydrophobicContact CG2-CG1 3.86Å; V42-V71 HydrophobicContact CG2-CG2 3.93Å; S58-V71 CarbonylContact O-C 3.5Å; S58-V71 WeakPolarHBondContact O-CA 3.37Å; L59-V71 HydrophobicContact CD2-CG2 3.91Å; V71-L130 CarbonylContact O-C 3.58Å; V71-L130 WeakPolarHBondContact O-CA 3.38Å; V71-L131 HydrophobicContact CB-CB 4.22Å; V71-L131 HydrophobicContact CB-CD1 4.49Å; V71-L131 HydrophobicContact CG1-CD1 4.49Å; V71-L131 PolarHBondContact N-O 3.36Å; V71-L131 PolarHBondContact O-N 2.89Å; V71-L133 HydrophobicContact CG2-CD1 3.95Å; V71-L133 HydrophobicContact CG2-CD2 3.88Å; V71-L133 HydrophobicContact CG2-CG 3.97Å
72	V	98.6	Very high	93.4	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.9	167.4	63.1	0	0	0	0	110	G57 S58 V60 I128 L130 L227 I230	G57-V72 CarbonylContact C-O 3.57Å; G57-V72 VanDerWaalsContact CA-O 3.3Å; G57-V72 WeakPolarHBondContact CA-O 3.01Å; S58-V72 PolarHBondContact N-O 3.07Å; S58-V72 PolarHBondContact O-N 3.17Å; V60-V72 HydrophobicContact CG1-CB 4.5Å; V60-V72 HydrophobicContact CG1-CG1 3.65Å; V72-I128 HydrophobicContact CG2-CD1 4.09Å; V72-I128 HydrophobicContact CG2-CG1 4.05Å; V72-L130 HydrophobicContact CB-CD2 3.64Å; V72-L130 HydrophobicContact CG2-CD2 3.68Å; V72-L227 HydrophobicContact CG1-CD2 3.33Å; V72-I230 HydrophobicContact CG2-CD1 3.47Å; V72-I230 VanDerWaalsContact CG2-CD1 3.47Å; V72-I230 HydrophobicContact CG2-CG1 4.39Å
73	T	98.1	Very high	93.2	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	-176.5	-179.7	-173	0	0	0	0	110.5	L44 A56 T129 L131	L44-T73 HydrophobicContact CD1-CG2 3.94Å; A56-T73 PolarHBondContact O-OG1 3.43Å; T73-T129 PolarHBondContact N-O 3.28Å; T73-T129 PolarHBondContact O-N 2.95Å; T73-L131 HydrophobicContact CG2-CD1 4.02Å; T73-L131 HydrophobicContact CG2-CD2 4.41Å; T73-L131 HydrophobicContact CG2-CG 4.07Å
74	A	95.8	Very high	93.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.194	C	C	.	.			trans	-76.5	146.8	174.2	0	0	0	0	0	111.2	C77 D127 I230	A74-C77 WeakPolarHBondContact O-CB 3.38Å; A74-C77 PolarHBondContact O-N 3Å; A74-D127 WeakPolarHBondContact CA-O 3.35Å; A74-I230 HydrophobicContact CB-CG2 4.35Å
75	A	95.1	Very high	93.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-71.8	-32	178.2	0	0	0	0	0	113	C77 V78 F79 Y119 D127 T129	A75-C77 PolarHBondContact O-N 3.36Å; A75-V78 VanDerWaalsContact O-CG2 3.29Å; A75-V78 WeakPolarHBondContact O-CG2 3.41Å; A75-V78 PolarHBondContact O-N 2.77Å; A75-V78 VanDerWaalsContact O-N 3.07Å; A75-F79 PolarHBondContact O-N 3.38Å; A75-Y119 HydrophobicContact CB-CD1 4.24Å; A75-Y119 HydrophobicContact CB-CD2 3.9Å; A75-Y119 HydrophobicContact CB-CG 3.72Å; A75-D127 WeakPolarHBondContact CA-OD1 3.31Å; A75-D127 PolarHBondContact N-OD1 3.33Å; A75-T129 WeakPolarHBondContact CA-OG1 3.32Å; A75-T129 VanDerWaalsContact CB-OG1 3.28Å; A75-T129 WeakPolarHBondContact CB-OG1 3.14Å
76	H	92.6	Very high	93.3	Very high	39 Å²	39	23.9 Å²	23.9	18%	0.181	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-63.9	-20.7	176.5	78.3	-104.3	0	0	0	112.7	V78 F79 Y119 D127 S213 S232	H76-V78 PolarHBondContact O-N 3.23Å; H76-F79 PolarHBondContact O-N 3.43Å; H76-F79 VanDerWaalsContact O-O 3.06Å; H76-Y119 HydrophobicContact CB-CE1 4.3Å; H76-Y119 HydrophobicContact CB-CE2 4.35Å; H76-Y119 WeakPolarHBondContact CB-OH 3.49Å; H76-D127 IonicContact CE1-OD2 3.23Å; H76-D127 IonicContact CG-OD1 3.88Å; H76-D127 IonicContact CG-OD2 3.42Å; H76-D127 PolarHBondContact N-OD1 2.83Å; H76-D127 IonicContact ND1-OD1 2.75Å; H76-D127 PolarHBondContact ND1-OD1 3.1Å; H76-D127 IonicContact ND1-OD2 2.71Å; H76-D127 PolarHBondContact ND1-OD2 3.17Å; H76-S213 PolarHBondContact CE1-OG 3.06Å; H76-S213 WeakPolarHBondContact NE2-CB 3.17Å; H76-S213 PolarHBondContact NE2-OG 2.68Å; H76-S232 PolarHBondContact CE1-O 3.44Å
77	C	94.3	Very high	93.4	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.014	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-65.6	-26.7	174	-68.3	0	0	0	0	113.1	C55 A74 A75	C55-C77 HydrophobicContact CB-CB 3.77Å; C55-C77 WeakPolarHBondContact CB-SG 3.5Å; C55-C77 WeakPolarHBondContact SG-CB 3.32Å; C55-C77 CovalentContact SG-SG 2.04Å; C55-C77 PolarHBondContact SG-SG 3.39Å; A74-C77 WeakPolarHBondContact O-CB 3.38Å; A74-C77 PolarHBondContact O-N 3Å; A75-C77 PolarHBondContact O-N 3.36Å
78	V	93.9	Very high	93.4	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.006	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-110.6	10.3	179.3	-56.8	0	0	0	0	112.6	A75 H76 Y84 L85 I90 Y114 T129 L131	A75-V78 VanDerWaalsContact O-CG2 3.29Å; A75-V78 WeakPolarHBondContact O-CG2 3.41Å; A75-V78 PolarHBondContact O-N 2.77Å; A75-V78 VanDerWaalsContact O-N 3.07Å; H76-V78 PolarHBondContact O-N 3.23Å; V78-Y84 HydrophobicContact CG2-CD1 4.21Å; V78-Y84 HydrophobicContact CG2-CE1 4.43Å; V78-Y84 WeakPolarHBondContact O-CA 3.27Å; V78-L85 PolarHBondContact O-N 2.78Å; V78-I90 HydrophobicContact CB-CD1 4.2Å; V78-I90 HydrophobicContact CG1-CD1 3.49Å; V78-I90 VanDerWaalsContact CG1-CD1 3.49Å; V78-I90 HydrophobicContact CG1-CG1 4.46Å; V78-Y114 HydrophobicContact CB-CE1 4.49Å; V78-Y114 HydrophobicContact CB-CE2 4.4Å; V78-Y114 HydrophobicContact CG2-CD2 4.3Å; V78-Y114 HydrophobicContact CG2-CE2 3.86Å; V78-T129 HydrophobicContact CG2-CG2 3.96Å; V78-L131 HydrophobicContact CG1-CD2 3.93Å
79	F	90.9	Very high	93.3	Very high	33 Å²	33	22.2 Å²	22.2	15%	0.145	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	116.3	-178.7	-174.9	-86.4	0	0	0	109.7	A75 H76 G82 S83 Y84 Y119 Y121	A75-F79 PolarHBondContact O-N 3.38Å; H76-F79 PolarHBondContact O-N 3.43Å; H76-F79 VanDerWaalsContact O-O 3.06Å; F79-G82 VanDerWaalsContact CZ-CA 3.44Å; F79-G82 WeakPolarHBondContact CZ-O 3.44Å; F79-S83 CarbonylContact C-O 3.6Å; F79-S83 WeakPolarHBondContact CA-O 3.44Å; F79-Y84 HydrophobicContact CB-CD1 4.43Å; F79-Y84 HydrophobicContact CB-CE1 4.44Å; F79-Y84 HydrophobicContact CD2-CD1 4.06Å; F79-Y84 HydrophobicContact CD2-CD2 4.03Å; F79-Y84 HydrophobicContact CD2-CE1 4.06Å; F79-Y84 HydrophobicContact CD2-CE2 4.02Å; F79-Y84 HydrophobicContact CD2-CG 4.05Å; F79-Y84 HydrophobicContact CE2-CD2 4.32Å; F79-Y84 HydrophobicContact CE2-CE2 4.26Å; F79-Y119 HydrophobicContact CB-CD1 4.25Å; F79-Y119 HydrophobicContact CB-CE1 4.08Å; F79-Y119 HydrophobicContact CD1-CD1 4.42Å; F79-Y119 AromaticContact CD1-CE1 3.88Å; F79-Y119 HydrophobicContact CD1-CE1 3.88Å; F79-Y119 HydrophobicContact CD2-CD1 4.38Å; F79-Y119 HydrophobicContact CE1-CE1 4.47Å; F79-Y119 HydrophobicContact CG-CD1 4.11Å; F79-Y119 AromaticContact CG-CE1 3.94Å; F79-Y119 HydrophobicContact CG-CE1 3.94Å; F79-Y121 AromaticContact CD1-CD2 3.86Å; F79-Y121 HydrophobicContact CD1-CD2 3.86Å; F79-Y121 AromaticContact CE1-CD2 3.55Å; F79-Y121 HydrophobicContact CE1-CD2 3.55Å; F79-Y121 HydrophobicContact CE1-CE2 4.27Å; F79-Y121 AromaticContact CE1-CG 3.84Å; F79-Y121 HydrophobicContact CE1-CG 3.84Å
80	H	87.7	Confident	93.3	Very high	67 Å²	67	22.1 Å²	22.1	31%	0.31	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	142.3	-177.7	-173	74.6	0	0	0	110.8	V48 G82 S83 L85	V48-H80 HydrophobicContact CG1-CB 4.12Å; H80-G82 PolarHBondContact O-N 3.03Å; H80-G82 VanDerWaalsContact O-N 3.14Å; H80-S83 PolarHBondContact N-O 2.8Å; H80-S83 PolarHBondContact O-N 2.81Å; H80-S83 PolarHBondContact O-OG 3.16Å; H80-L85 HydrophobicContact CB-CD1 3.86Å; H80-L85 HydrophobicContact CB-CD2 4.05Å; H80-L85 HydrophobicContact CB-CG 4Å
81	S	84.6	Confident	93.2	Very high	105 Å²	105	24.5 Å²	24.5	73%	0.734	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	39	178.3	-68.3	0	0	0	0	114.2	S83	S81-S83 VanDerWaalsContact C-N 3.31Å; S81-S83 PolarHBondContact O-N 2.82Å
82	G	82.6	Confident	93.2	Very high	54 Å²	54	24.5 Å²	24.5	56%	0.557	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.3	6.5	177.2	0	0	0	0	0	115.1	F79 H80	F79-G82 VanDerWaalsContact CZ-CA 3.44Å; F79-G82 WeakPolarHBondContact CZ-O 3.44Å; H80-G82 PolarHBondContact O-N 3.03Å; H80-G82 VanDerWaalsContact O-N 3.14Å
83	S	87	Confident	93.1	Very high	43 Å²	43	24.6 Å²	24.6	30%	0.301	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	154.4	-178.2	68	0	0	0	0	112.6	F79 H80 S81	F79-S83 CarbonylContact C-O 3.6Å; F79-S83 WeakPolarHBondContact CA-O 3.44Å; H80-S83 PolarHBondContact N-O 2.8Å; H80-S83 PolarHBondContact O-N 2.81Å; H80-S83 PolarHBondContact O-OG 3.16Å; S81-S83 VanDerWaalsContact C-N 3.31Å; S81-S83 PolarHBondContact O-N 2.82Å
84	Y	90.7	Very high	93.1	Very high	31 Å²	31	24.6 Å²	24.6	12%	0.122	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	124.9	170.7	-80	-74	0	0	0	109.7	V78 F79 Y114 S116 Y119 I278 M308	V78-Y84 HydrophobicContact CG2-CD1 4.21Å; V78-Y84 HydrophobicContact CG2-CE1 4.43Å; V78-Y84 WeakPolarHBondContact O-CA 3.27Å; F79-Y84 HydrophobicContact CB-CD1 4.43Å; F79-Y84 HydrophobicContact CB-CE1 4.44Å; F79-Y84 HydrophobicContact CD2-CD1 4.06Å; F79-Y84 HydrophobicContact CD2-CD2 4.03Å; F79-Y84 HydrophobicContact CD2-CE1 4.06Å; F79-Y84 HydrophobicContact CD2-CE2 4.02Å; F79-Y84 HydrophobicContact CD2-CG 4.05Å; F79-Y84 HydrophobicContact CE2-CD2 4.32Å; F79-Y84 HydrophobicContact CE2-CE2 4.26Å; Y84-Y114 WeakPolarHBondContact CB-OH 3.41Å; Y84-Y114 HydrophobicContact CD1-CE2 4.04Å; Y84-S116 VanDerWaalsContact CE1-OG 3.29Å; Y84-S116 WeakPolarHBondContact CE1-OG 3.4Å; Y84-Y119 WeakPolarHBondContact OH-CB 3.32Å; Y84-I278 PolarHBondContact O-N 2.88Å; Y84-M308 HydrophobicContact CE2-CE 3.94Å
85	L	92.5	Very high	93.2	Very high	16 Å²	16	24.8 Å²	24.8	8%	0.084	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-70.4	142.7	177.2	-66	169.9	0	0	0	109.7	I46 V48 V78 H80 Y114	I46-L85 HydrophobicContact CG2-CD1 3.35Å; V48-L85 HydrophobicContact CG1-CD1 3.57Å; V48-L85 HydrophobicContact CG1-CD2 4.28Å; V78-L85 PolarHBondContact O-N 2.78Å; H80-L85 HydrophobicContact CB-CD1 3.86Å; H80-L85 HydrophobicContact CB-CD2 4.05Å; H80-L85 HydrophobicContact CB-CG 4Å; L85-Y114 VanDerWaalsContact O-CE1 3.25Å; L85-Y114 WeakPolarHBondContact O-CE1 3.46Å; L85-Y114 VanDerWaalsContact O-CZ 3.29Å; L85-Y114 PolarHBondContact O-OH 3.08Å
86	P	93.6	Very high	93.1	Very high	4 Å²	4	25.1 Å²	25.1	3%	0.026	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-73.9	154.4	-178.2	34.1	-35.6	0	0	0	111.2	G88 N89 R274 T275 D276	P86-G88 PolarHBondContact O-N 3Å; P86-N89 WeakPolarHBondContact CG-OD1 3.3Å; P86-N89 WeakPolarHBondContact O-CB 3.49Å; P86-N89 PolarHBondContact O-N 2.9Å; P86-N89 VanDerWaalsContact O-N 3.08Å; P86-R274 HydrophobicContact CB-CB 4.45Å; P86-R274 HydrophobicContact CB-CG 4.07Å; P86-R274 VanDerWaalsContact CB-O 3.3Å; P86-R274 WeakPolarHBondContact CB-O 3.34Å; P86-T275 VanDerWaalsContact CG-C 3.49Å; P86-T275 WeakPolarHBondContact CG-O 3.49Å; P86-D276 WeakPolarHBondContact CB-O 3.09Å
87	P	95.5	Very high	93.2	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.006	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-57.8	-31.7	-174.1	-27.1	36.7	0	0	0	114.7	N89 I90 V111 Y114 E271	P87-N89 PolarHBondContact O-N 2.64Å; P87-N89 VanDerWaalsContact O-N 3.13Å; P87-I90 PolarHBondContact O-N 3.16Å; P87-V111 HydrophobicContact CB-CB 4.29Å; P87-V111 HydrophobicContact CB-CG1 4.09Å; P87-V111 WeakPolarHBondContact CB-O 3.2Å; P87-Y114 HydrophobicContact CB-CD1 4.35Å; P87-Y114 HydrophobicContact CG-CD1 3.87Å; P87-Y114 HydrophobicContact CG-CE1 3.93Å; P87-E271 HydrophobicContact CG-CB 3.86Å
88	G	95.4	Very high	93.1	Very high	35 Å²	35	23.9 Å²	23.9	36%	0.361	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-65.9	-11.1	178.1	0	0	0	0	0	115.5	P86 I90 E272 R274	P86-G88 PolarHBondContact O-N 3Å; G88-I90 VanDerWaalsContact C-N 3.31Å; G88-E272 WeakPolarHBondContact CA-O 3.12Å; G88-E272 PolarHBondContact N-O 3.04Å; G88-R274 WeakPolarHBondContact CA-O 3.18Å; G88-R274 PolarHBondContact N-O 3.25Å
89	N	95.6	Very high	92.9	Very high	29 Å²	29	25 Å²	25	16%	0.155	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-84.8	-6	173	-74.8	48.5	0	0	0	112.8	I46 D47 P86 P87	I46-N89 CarbonylContact C-O 3.55Å; I46-N89 WeakPolarHBondContact CA-O 3.49Å; D47-N89 HydrophobicContact CB-CB 4.27Å; D47-N89 PolarHBondContact N-O 3.48Å; D47-N89 WeakPolarHBondContact O-CB 3.35Å; D47-N89 PolarHBondContact O-ND2 3.24Å; P86-N89 WeakPolarHBondContact CG-OD1 3.3Å; P86-N89 WeakPolarHBondContact O-CB 3.49Å; P86-N89 PolarHBondContact O-N 2.9Å; P86-N89 VanDerWaalsContact O-N 3.08Å; P87-N89 PolarHBondContact O-N 2.64Å; P87-N89 VanDerWaalsContact O-N 3.13Å
90	I	97.4	Very high	92.8	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.01	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.6	-170	-51.5	165	0	0	0	109.3	L44 I46 V78 P87 G88 V111 Y114 L131	L44-I90 HydrophobicContact CD2-CG2 4.42Å; I46-I90 HydrophobicContact CG1-CG1 4.36Å; I46-I90 HydrophobicContact CG1-CG2 4.24Å; I46-I90 HydrophobicContact CG2-CG1 4.31Å; V78-I90 HydrophobicContact CB-CD1 4.2Å; V78-I90 HydrophobicContact CG1-CD1 3.49Å; V78-I90 VanDerWaalsContact CG1-CD1 3.49Å; V78-I90 HydrophobicContact CG1-CG1 4.46Å; P87-I90 PolarHBondContact O-N 3.16Å; G88-I90 VanDerWaalsContact C-N 3.31Å; I90-V111 HydrophobicContact CB-CB 4.21Å; I90-V111 HydrophobicContact CB-CG2 3.76Å; I90-V111 HydrophobicContact CG2-CG2 3.58Å; I90-V111 PolarHBondContact O-N 3.44Å; I90-Y114 HydrophobicContact CD1-CD1 4.06Å; I90-Y114 HydrophobicContact CD1-CE1 3.99Å; I90-L131 HydrophobicContact CD1-CD2 4.42Å; I90-L131 HydrophobicContact CG2-CD1 4.24Å
91	T	97.2	Very high	92.8	Very high	51 Å²	51	30.1 Å²	30.1	31%	0.313	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.1	171.2	-59.9	0	0	0	0	109.7	L44 E45 Y108	L44-T91 WeakPolarHBondContact CA-O 3.41Å; E45-T91 PolarHBondContact N-O 2.85Å; E45-T91 PolarHBondContact O-N 2.91Å; T91-Y108 HydrophobicContact CG2-CD1 4.45Å
92	A	98.3	Very high	92.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.8	175.1	0	0	0	0	0	110.6	V42 L44 L109 L133	V42-A92 HydrophobicContact CG1-CB 3.84Å; L44-A92 HydrophobicContact CD2-CB 3.85Å; A92-L109 HydrophobicContact CB-CB 4.49Å; A92-L109 PolarHBondContact N-O 2.71Å; A92-L109 PolarHBondContact O-N 3.23Å; A92-L133 HydrophobicContact CB-CD2 3.48Å; A92-L133 VanDerWaalsContact CB-CD2 3.48Å
93	I	97.4	Very high	93.3	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	122	174.1	-46.5	-180	0	0	0	108.4	Y43 A96 F106 S107 Y108	Y43-I93 HydrophobicContact CD1-CD1 3.82Å; Y43-I93 HydrophobicContact CD1-CG1 4.29Å; Y43-I93 HydrophobicContact CE1-CD1 4.36Å; Y43-I93 PolarHBondContact N-O 2.91Å; Y43-I93 PolarHBondContact O-N 2.84Å; I93-A96 HydrophobicContact CG2-CB 4.29Å; I93-F106 HydrophobicContact CG2-CB 4.43Å; I93-F106 HydrophobicContact CG2-CD2 3.87Å; I93-F106 HydrophobicContact CG2-CE2 4.28Å; I93-F106 HydrophobicContact CG2-CG 4.09Å; I93-S107 WeakPolarHBondContact CA-O 2.97Å; I93-Y108 HydrophobicContact CD1-CD1 3.82Å; I93-Y108 HydrophobicContact CD1-CE1 3.42Å; I93-Y108 VanDerWaalsContact CD1-CE1 3.42Å; I93-Y108 HydrophobicContact CG1-CD1 3.74Å; I93-Y108 HydrophobicContact CG1-CE1 3.87Å; I93-Y108 HydrophobicContact CG2-CE1 4.47Å
94	V	97.8	Very high	93.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	160.7	176.1	-57	0	0	0	0	111.4	V42 L59 A96 F106 S107 L109 V137 V143	V42-V94 HydrophobicContact CG1-CG1 4.22Å; V42-V94 HydrophobicContact CG2-CG1 4.09Å; L59-V94 HydrophobicContact CD1-CB 4.45Å; L59-V94 HydrophobicContact CD1-CG1 4.1Å; L59-V94 HydrophobicContact CD2-CG1 4.28Å; L59-V94 HydrophobicContact CG-CG1 4.43Å; V94-A96 PolarHBondContact O-N 3.02Å; V94-F106 WeakPolarHBondContact O-CA 3.02Å; V94-S107 PolarHBondContact N-O 3.35Å; V94-S107 VanDerWaalsContact N-O 3.09Å; V94-S107 PolarHBondContact O-N 3.25Å; V94-S107 VanDerWaalsContact O-N 3.13Å; V94-L109 HydrophobicContact CG1-CD1 4.09Å; V94-L109 HydrophobicContact CG2-CD1 3.76Å; V94-V137 HydrophobicContact CG2-CG1 3.91Å; V94-V143 HydrophobicContact CB-CG2 4.36Å; V94-V143 HydrophobicContact CG2-CG1 4.41Å; V94-V143 HydrophobicContact CG2-CG2 4.11Å
95	G	96.3	Very high	93.7	Very high	4 Å²	4	38 Å²	38	4%	0.041	21%	0.205	C	C	.	.	S	Bend	trans	75.4	8	176.5	0	0	0	0	0	114.7	H36 S105	H36-G95 PolarHBondContact ND1-O 2.7Å; G95-S105 WeakPolarHBondContact CA-O 3.49Å; G95-S105 WeakPolarHBondContact O-CB 3.46Å; G95-S105 PolarHBondContact O-OG 3.4Å
96	A	94.8	Very high	93.7	Very high	7 Å²	7	38.3 Å²	38.3	6%	0.058	21%	0.206	C	C	.	.			trans	-84	141.8	-177.5	0	0	0	0	0	113.9	I93 V94 V99 F106 W166	I93-A96 HydrophobicContact CG2-CB 4.29Å; V94-A96 PolarHBondContact O-N 3.02Å; A96-V99 HydrophobicContact CB-CG1 3.9Å; A96-F106 HydrophobicContact CB-CD1 3.75Å; A96-F106 HydrophobicContact CB-CE1 3.26Å; A96-F106 HydrophobicContact CB-CE2 4.45Å; A96-F106 HydrophobicContact CB-CZ 3.65Å; A96-W166 HydrophobicContact CB-CZ2 4.35Å
97	H	94.2	Very high	93.8	Very high	8 Å²	8	40.6 Å²	40.6	4%	0.037	22%	0.222	C	C	.	.	S	Bend	trans	-114.3	-50.3	165.2	175.2	71.9	0	0	0	112.2	Q32 A33 P35 E103 W166 R176 L177	Q32-H97 PolarHBondContact NE2-NE2 2.86Å; A33-H97 PolarHBondContact O-CE1 3.12Å; P35-H97 WeakPolarHBondContact CA-ND1 3.14Å; P35-H97 HydrophobicContact CB-CB 4.27Å; H97-E103 PolarHBondContact N-OE2 3.17Å; H97-W166 PolarHBondContact O-NE1 3.04Å; H97-R176 WeakPolarHBondContact O-CA 3.33Å; H97-L177 PolarHBondContact O-N 2.84Å
98	D	92	Very high	93.8	Very high	6 Å²	6	46.3 Å²	46.3	3%	0.032	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-109.8	96.5	175.7	-163	-8.3	0	0	0	109.2	D100 K101 E103 F106 R176	D98-D100 PolarHBondContact O-N 3Å; D98-K101 HydrophobicContact CB-CB 4.42Å; D98-K101 HydrophobicContact CB-CD 4.49Å; D98-K101 PolarHBondContact O-N 2.81Å; D98-E103 PolarHBondContact N-OE1 3.38Å; D98-F106 WeakPolarHBondContact O-CZ 3.23Å; D98-R176 HydrophobicContact CB-CG 3.94Å; D98-R176 WeakPolarHBondContact OD1-CG 3.35Å; D98-R176 IonicContact OD1-NE 3.89Å; D98-R176 IonicContact OD2-CZ 3.82Å; D98-R176 IonicContact OD2-NE 3.51Å; D98-R176 PolarHBondContact OD2-NE 3.16Å; D98-R176 IonicContact OD2-NH2 3.29Å; D98-R176 PolarHBondContact OD2-NH2 2.93Å
99	V	89.8	Confident	93.9	Very high	24 Å²	24	44.9 Å²	44.9	15%	0.145	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-13.2	-173.9	-62.2	0	0	0	0	113.5	Y43 A96 K101 W166 L175	Y43-V99 HydrophobicContact CD1-CG1 4.33Å; Y43-V99 HydrophobicContact CD2-CG1 4.09Å; Y43-V99 HydrophobicContact CD2-CG2 4.47Å; Y43-V99 HydrophobicContact CE2-CG2 4.11Å; Y43-V99 HydrophobicContact CG-CG1 3.97Å; A96-V99 HydrophobicContact CB-CG1 3.9Å; V99-K101 PolarHBondContact O-N 2.82Å; V99-W166 HydrophobicContact CG1-CD2 4.35Å; V99-W166 HydrophobicContact CG1-CG 4.35Å; V99-W166 HydrophobicContact CG1-CZ2 4.34Å; V99-W166 HydrophobicContact CG2-CG 4.4Å; V99-L175 HydrophobicContact CG2-CB 3.3Å; V99-L175 HydrophobicContact CG2-CD1 3.79Å; V99-L175 HydrophobicContact CG2-CG 4.18Å; V99-L175 WeakPolarHBondContact CG2-O 3.39Å; V99-L175 PolarHBondContact N-O 2.96Å
100	D	88	Confident	94.1	Very high	92 Å²	92	44.3 Å²	44.3	49%	0.492	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-3.2	171.3	-64.6	-37.2	0	0	0	112.9	D98 K174 L175	D98-D100 PolarHBondContact O-N 3Å; D100-K174 WeakPolarHBondContact OD2-CA 3.24Å; D100-L175 WeakPolarHBondContact OD1-CD1 3.46Å; D100-L175 PolarHBondContact OD2-N 3.06Å
101	K	87.9	Confident	94.1	Very high	116 Å²	116	44.3 Å²	44.3	50%	0.504	23%	0.23	S	C	.	.	S	Bend	trans	-132.8	125.2	-178.3	-62.5	-173.6	178.5	-160.9	0	109.6	D98 V99 E103 F106	D98-K101 HydrophobicContact CB-CB 4.42Å; D98-K101 HydrophobicContact CB-CD 4.49Å; D98-K101 PolarHBondContact O-N 2.81Å; V99-K101 PolarHBondContact O-N 2.82Å; K101-E103 PolarHBondContact O-N 2.98Å; K101-F106 WeakPolarHBondContact O-CE2 3.38Å; K101-F106 WeakPolarHBondContact O-CZ 3.32Å
102	E	87.1	Confident	94.1	Very high	162 Å²	162	45 Å²	45	76%	0.757	23%	0.226	S	C	*	.			trans	-64.1	102.6	169.6	-165.4	176.3	175.8	0	0	109.4
103	E	90.9	Very high	94	Very high	41 Å²	41	45.2 Å²	45.2	19%	0.192	23%	0.228	C	C	.	.			trans	-89.6	144.9	176.1	-56.2	174.7	154.9	0	0	109	H36 H97 D98 K101 S105 F106	H36-E103 IonicContact CE1-OE2 2.68Å; H36-E103 PolarHBondContact CE1-OE2 3.11Å; H97-E103 PolarHBondContact N-OE2 3.17Å; D98-E103 PolarHBondContact N-OE1 3.38Å; K101-E103 PolarHBondContact O-N 2.98Å; E103-S105 PolarHBondContact O-N 3.39Å; E103-F106 HydrophobicContact CB-CD1 3.59Å; E103-F106 HydrophobicContact CB-CE1 3.48Å; E103-F106 VanDerWaalsContact CB-CE1 3.48Å; E103-F106 HydrophobicContact CB-CZ 4.37Å; E103-F106 HydrophobicContact CG-CD1 4.2Å; E103-F106 HydrophobicContact CG-CE1 3.55Å; E103-F106 HydrophobicContact CG-CZ 4.17Å; E103-F106 VanDerWaalsContact O-CB 3.32Å; E103-F106 WeakPolarHBondContact O-CB 3.37Å; E103-F106 WeakPolarHBondContact O-CG 3.45Å; E103-F106 PolarHBondContact O-N 3.22Å; E103-F106 WeakPolarHBondContact OE2-CE1 3.45Å
104	N	92.4	Very high	94	Very high	179 Å²	179	46.5 Å²	46.5	96%	0.957	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-13.1	176.4	-65.8	-12.7	0	0	0	114.2
105	S	92.8	Very high	93.9	Very high	17 Å²	17	48.4 Å²	48.4	12%	0.119	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-5.1	175.9	53.1	0	0	0	0	113.7	H36 G95 E103	H36-S105 PolarHBondContact CE1-OG 2.89Å; G95-S105 WeakPolarHBondContact CA-O 3.49Å; G95-S105 WeakPolarHBondContact O-CB 3.46Å; G95-S105 PolarHBondContact O-OG 3.4Å; E103-S105 PolarHBondContact O-N 3.39Å
106	F	93.2	Very high	93.7	Very high	22 Å²	22	49.2 Å²	49.2	10%	0.096	25%	0.249	C	C	.	.			trans	-67.2	145.7	179.7	-78.1	23	0	0	0	110.6	I93 V94 A96 D98 K101 E103 Y108	I93-F106 HydrophobicContact CG2-CB 4.43Å; I93-F106 HydrophobicContact CG2-CD2 3.87Å; I93-F106 HydrophobicContact CG2-CE2 4.28Å; I93-F106 HydrophobicContact CG2-CG 4.09Å; V94-F106 WeakPolarHBondContact O-CA 3.02Å; A96-F106 HydrophobicContact CB-CD1 3.75Å; A96-F106 HydrophobicContact CB-CE1 3.26Å; A96-F106 HydrophobicContact CB-CE2 4.45Å; A96-F106 HydrophobicContact CB-CZ 3.65Å; D98-F106 WeakPolarHBondContact O-CZ 3.23Å; K101-F106 WeakPolarHBondContact O-CE2 3.38Å; K101-F106 WeakPolarHBondContact O-CZ 3.32Å; E103-F106 HydrophobicContact CB-CD1 3.59Å; E103-F106 HydrophobicContact CB-CE1 3.48Å; E103-F106 VanDerWaalsContact CB-CE1 3.48Å; E103-F106 HydrophobicContact CB-CZ 4.37Å; E103-F106 HydrophobicContact CG-CD1 4.2Å; E103-F106 HydrophobicContact CG-CE1 3.55Å; E103-F106 HydrophobicContact CG-CZ 4.17Å; E103-F106 VanDerWaalsContact O-CB 3.32Å; E103-F106 WeakPolarHBondContact O-CB 3.37Å; E103-F106 WeakPolarHBondContact O-CG 3.45Å; E103-F106 PolarHBondContact O-N 3.22Å; E103-F106 WeakPolarHBondContact OE2-CE1 3.45Å; F106-Y108 HydrophobicContact CB-CE2 4.11Å; F106-Y108 AromaticContact CD2-CE2 3.89Å; F106-Y108 HydrophobicContact CD2-CE2 3.89Å; F106-Y108 AromaticContact CD2-CZ 3.77Å; F106-Y108 WeakPolarHBondContact CD2-OH 3.07Å
107	S	95.5	Very high	93.4	Very high	52 Å²	52	51.3 Å²	51.3	36%	0.364	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	121.3	159.6	-52.7	0	0	0	0	107.8	I93 V94	I93-S107 WeakPolarHBondContact CA-O 2.97Å; V94-S107 PolarHBondContact N-O 3.35Å; V94-S107 VanDerWaalsContact N-O 3.09Å; V94-S107 PolarHBondContact O-N 3.25Å; V94-S107 VanDerWaalsContact O-N 3.13Å
108	Y	96.5	Very high	92.6	Very high	121 Å²	121	53.6 Å²	53.6	48%	0.475	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.7	176.4	-66.1	-94.3	0	0	0	108.4	T91 I93 F106	T91-Y108 HydrophobicContact CG2-CD1 4.45Å; I93-Y108 HydrophobicContact CD1-CD1 3.82Å; I93-Y108 HydrophobicContact CD1-CE1 3.42Å; I93-Y108 VanDerWaalsContact CD1-CE1 3.42Å; I93-Y108 HydrophobicContact CG1-CD1 3.74Å; I93-Y108 HydrophobicContact CG1-CE1 3.87Å; I93-Y108 HydrophobicContact CG2-CE1 4.47Å; F106-Y108 HydrophobicContact CB-CE2 4.11Å; F106-Y108 AromaticContact CD2-CE2 3.89Å; F106-Y108 HydrophobicContact CD2-CE2 3.89Å; F106-Y108 AromaticContact CD2-CZ 3.77Å; F106-Y108 WeakPolarHBondContact CD2-OH 3.07Å
109	L	97.9	Very high	91.8	Very high	5 Å²	5	54.4 Å²	54.4	3%	0.026	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	133.2	-170.9	-61.2	136.5	0	0	0	109.1	A92 V94 L133 E135 V137	A92-L109 HydrophobicContact CB-CB 4.49Å; A92-L109 PolarHBondContact N-O 2.71Å; A92-L109 PolarHBondContact O-N 3.23Å; V94-L109 HydrophobicContact CG1-CD1 4.09Å; V94-L109 HydrophobicContact CG2-CD1 3.76Å; L109-L133 HydrophobicContact CB-CD2 4.14Å; L109-L133 HydrophobicContact CD1-CD1 4.16Å; L109-E135 HydrophobicContact CD2-CG 3.36Å; L109-V137 HydrophobicContact CD1-CG1 3.3Å; L109-V137 HydrophobicContact CD2-CG1 3.96Å; L109-V137 HydrophobicContact CG-CG1 4.27Å
110	G	97.9	Very high	91	Very high	18 Å²	18	54 Å²	54	19%	0.186	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	170.2	167.1	0	0	0	0	0	111.4	L133 S134	G110-L133 CarbonylContact O-C 3.42Å; G110-L133 WeakPolarHBondContact O-CA 3.41Å; G110-S134 PolarHBondContact N-OG 2.8Å; G110-S134 PolarHBondContact O-N 2.85Å; G110-S134 PolarHBondContact O-OG 3.39Å
111	V	98.3	Very high	90.2	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	117.3	170.6	177.4	0	0	0	0	109.1	P87 I90 N113 L131 R132 E272	P87-V111 HydrophobicContact CB-CB 4.29Å; P87-V111 HydrophobicContact CB-CG1 4.09Å; P87-V111 WeakPolarHBondContact CB-O 3.2Å; I90-V111 HydrophobicContact CB-CB 4.21Å; I90-V111 HydrophobicContact CB-CG2 3.76Å; I90-V111 HydrophobicContact CG2-CG2 3.58Å; I90-V111 PolarHBondContact O-N 3.44Å; V111-N113 WeakPolarHBondContact CG1-O 3.37Å; V111-L131 HydrophobicContact CG1-CB 4.04Å; V111-L131 HydrophobicContact CG1-CD2 4.42Å; V111-L131 HydrophobicContact CG2-CB 4.29Å; V111-L131 HydrophobicContact CG2-CD1 4.21Å; V111-R132 CarbonylContact C-O 3.53Å; V111-R132 WeakPolarHBondContact CG1-O 3.46Å; V111-E272 WeakPolarHBondContact O-CA 3.3Å
112	R	97.4	Very high	89.3	Confident	65 Å²	65	56.1 Å²	56.1	25%	0.245	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	-50.5	176.1	-168.2	-174.4	177.3	79	8	111.9	R132 D270 E271 E272	R112-R132 HydrophobicContact CB-CG 4.45Å; R112-R132 WeakPolarHBondContact CB-O 2.99Å; R112-R132 PolarHBondContact N-O 3.42Å; R112-D270 HydrophobicContact CG-CB 4.27Å; R112-D270 WeakPolarHBondContact CG-OD1 3.48Å; R112-D270 IonicContact CZ-OD2 3.56Å; R112-D270 IonicContact NE-OD2 3.44Å; R112-D270 IonicContact NH1-OD2 3.44Å; R112-D270 PolarHBondContact NH1-OD2 3.21Å; R112-D270 IonicContact NH2-OD2 3.95Å; R112-D270 PolarHBondContact NH2-OD2 3.09Å; R112-E271 CarbonylContact O-C 3.54Å; R112-E271 VanDerWaalsContact O-CA 3.32Å; R112-E271 WeakPolarHBondContact O-CA 3.06Å; R112-E271 PolarHBondContact O-N 3.45Å; R112-E272 PolarHBondContact O-N 3.31Å
113	N	96.5	Very high	88.6	Confident	6 Å²	6	50.1 Å²	50.1	3%	0.032	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.7	168	-179	50.7	49	0	0	0	109.1	V111 R132 L265 A268 P269	V111-N113 WeakPolarHBondContact CG1-O 3.37Å; N113-R132 PolarHBondContact O-N 3.45Å; N113-R132 WeakPolarHBondContact OD1-CB 3.4Å; N113-L265 WeakPolarHBondContact OD1-CD2 3.32Å; N113-A268 PolarHBondContact ND2-O 3.08Å; N113-P269 PolarHBondContact ND2-O 2.92Å
114	Y	97.3	Very high	87.8	Confident	31 Å²	31	50.4 Å²	50.4	12%	0.122	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	166.8	176.2	68	-103.6	0	0	0	112.3	V78 Y84 L85 P87 I90 T129 L130 L131 I278	V78-Y114 HydrophobicContact CB-CE1 4.49Å; V78-Y114 HydrophobicContact CB-CE2 4.4Å; V78-Y114 HydrophobicContact CG2-CD2 4.3Å; V78-Y114 HydrophobicContact CG2-CE2 3.86Å; Y84-Y114 WeakPolarHBondContact CB-OH 3.41Å; Y84-Y114 HydrophobicContact CD1-CE2 4.04Å; L85-Y114 VanDerWaalsContact O-CE1 3.25Å; L85-Y114 WeakPolarHBondContact O-CE1 3.46Å; L85-Y114 VanDerWaalsContact O-CZ 3.29Å; L85-Y114 PolarHBondContact O-OH 3.08Å; P87-Y114 HydrophobicContact CB-CD1 4.35Å; P87-Y114 HydrophobicContact CG-CD1 3.87Å; P87-Y114 HydrophobicContact CG-CE1 3.93Å; I90-Y114 HydrophobicContact CD1-CD1 4.06Å; I90-Y114 HydrophobicContact CD1-CE1 3.99Å; Y114-T129 HydrophobicContact CD2-CG2 3.81Å; Y114-T129 HydrophobicContact CG-CG2 4.24Å; Y114-L130 CarbonylContact C-O 3.55Å; Y114-L130 WeakPolarHBondContact CA-O 3.37Å; Y114-L130 WeakPolarHBondContact CB-O 3.3Å; Y114-L131 HydrophobicContact CD1-CD2 4.36Å; Y114-L131 HydrophobicContact CG-CD2 4.07Å; Y114-I278 HydrophobicContact CE1-CD1 4.26Å; Y114-I278 HydrophobicContact CE2-CD1 4.48Å; Y114-I278 WeakPolarHBondContact OH-CD1 3.22Å
115	V	94.7	Very high	87.2	Confident	39 Å²	39	42.4 Å²	42.4	24%	0.236	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	130.4	174.6	62.9	0	0	0	0	111.1	T129 L130 W257 L265	V115-T129 WeakPolarHBondContact O-CA 3.48Å; V115-L130 HydrophobicContact CG1-CB 4.19Å; V115-L130 PolarHBondContact N-O 2.88Å; V115-L130 PolarHBondContact O-N 2.95Å; V115-W257 HydrophobicContact CG1-CZ2 4.22Å; V115-W257 HydrophobicContact CG2-CZ2 4.33Å; V115-L265 HydrophobicContact CB-CD2 4.22Å; V115-L265 HydrophobicContact CG1-CD1 3.98Å; V115-L265 HydrophobicContact CG1-CD2 4.01Å; V115-L265 HydrophobicContact CG1-CG 3.98Å
116	S	93.2	Very high	86.8	Confident	22 Å²	22	41.6 Å²	41.6	15%	0.154	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	143.2	178.7	-51.6	0	0	0	0	110.8	Y84 F118 T129	Y84-S116 VanDerWaalsContact CE1-OG 3.29Å; Y84-S116 WeakPolarHBondContact CE1-OG 3.4Å; S116-F118 PolarHBondContact O-N 3.25Å; S116-T129 VanDerWaalsContact CB-OG1 3.23Å; S116-T129 WeakPolarHBondContact CB-OG1 3.16Å; S116-T129 PolarHBondContact OG-OG1 2.81Å
117	Y	88.4	Confident	86.8	Confident	51 Å²	51	40.6 Å²	40.6	20%	0.2	20%	0.196	C	C	.	.			trans	-92.2	96.4	179.8	-172.7	-107.5	0	0	0	111.7	Y119 N126 I128 F254 W257	Y117-Y119 PolarHBondContact O-N 3.08Å; Y117-N126 HydrophobicContact CD1-CB 3.79Å; Y117-N126 HydrophobicContact CE1-CB 4.44Å; Y117-N126 WeakPolarHBondContact O-CB 3.37Å; Y117-I128 PolarHBondContact N-O 2.97Å; Y117-F254 AromaticContact CD1-CD1 3.94Å; Y117-F254 HydrophobicContact CD1-CD1 3.94Å; Y117-F254 AromaticContact CD1-CE1 3.46Å; Y117-F254 HydrophobicContact CD1-CE1 3.46Å; Y117-F254 VanDerWaalsContact CD1-CE1 3.46Å; Y117-F254 HydrophobicContact CE1-CD1 4.23Å; Y117-F254 AromaticContact CE1-CE1 3.68Å; Y117-F254 HydrophobicContact CE1-CE1 3.68Å; Y117-F254 HydrophobicContact CG-CD1 4.38Å; Y117-F254 HydrophobicContact CG-CE1 4.3Å; Y117-W257 HydrophobicContact CD2-CB 4.49Å; Y117-W257 AromaticContact CD2-CD1 3.27Å; Y117-W257 AromaticContact CD2-CD2 3.82Å; Y117-W257 HydrophobicContact CD2-CD2 3.82Å; Y117-W257 AromaticContact CD2-CE2 3.65Å; Y117-W257 AromaticContact CD2-CG 3.6Å; Y117-W257 HydrophobicContact CD2-CG 3.6Å; Y117-W257 HydrophobicContact CD2-CZ2 4.47Å; Y117-W257 AromaticContact CD2-NE1 3.31Å; Y117-W257 VanDerWaalsContact CD2-NE1 3.31Å; Y117-W257 HydrophobicContact CE2-CB 4.48Å; Y117-W257 AromaticContact CE2-CD1 3.66Å; Y117-W257 AromaticContact CE2-CG 3.99Å; Y117-W257 HydrophobicContact CE2-CG 3.99Å; Y117-W257 HydrophobicContact CG-CD2 4.11Å; Y117-W257 HydrophobicContact CG-CG 4.29Å; Y117-W257 HydrophobicContact CG-CZ2 4.49Å
118	F	76.8	Confident	86.7	Confident	56 Å²	56	38.1 Å²	38.1	25%	0.246	18%	0.178	C	C	.	.			trans	37.6	46	168.1	-53.2	-56.4	0	0	0	115	S116 N120 N126 I311 Y315	S116-F118 PolarHBondContact O-N 3.25Å; F118-N120 PolarHBondContact O-N 3.37Å; F118-N126 PolarHBondContact O-ND2 3.13Å; F118-I311 HydrophobicContact CD1-CG2 3.73Å; F118-I311 HydrophobicContact CE1-CG2 3.36Å; F118-I311 HydrophobicContact CZ-CG2 4.11Å; F118-Y315 HydrophobicContact CZ-CE2 4.25Å
119	Y	74.8	Confident	86.7	Confident	22 Å²	22	32.3 Å²	32.3	9%	0.086	16%	0.156	C	C	.	.			trans	-60.8	128.4	-174.1	172.4	-124	0	0	0	110.1	A75 H76 F79 Y84 Y117 Y121 D124 D127	A75-Y119 HydrophobicContact CB-CD1 4.24Å; A75-Y119 HydrophobicContact CB-CD2 3.9Å; A75-Y119 HydrophobicContact CB-CG 3.72Å; H76-Y119 HydrophobicContact CB-CE1 4.3Å; H76-Y119 HydrophobicContact CB-CE2 4.35Å; H76-Y119 WeakPolarHBondContact CB-OH 3.49Å; F79-Y119 HydrophobicContact CB-CD1 4.25Å; F79-Y119 HydrophobicContact CB-CE1 4.08Å; F79-Y119 HydrophobicContact CD1-CD1 4.42Å; F79-Y119 AromaticContact CD1-CE1 3.88Å; F79-Y119 HydrophobicContact CD1-CE1 3.88Å; F79-Y119 HydrophobicContact CD2-CD1 4.38Å; F79-Y119 HydrophobicContact CE1-CE1 4.47Å; F79-Y119 HydrophobicContact CG-CD1 4.11Å; F79-Y119 AromaticContact CG-CE1 3.94Å; F79-Y119 HydrophobicContact CG-CE1 3.94Å; Y84-Y119 WeakPolarHBondContact OH-CB 3.32Å; Y117-Y119 PolarHBondContact O-N 3.08Å; Y119-Y121 HydrophobicContact CE1-CD2 4.27Å; Y119-D124 HydrophobicContact CE2-CB 4.48Å; Y119-D124 PolarHBondContact OH-OD1 2.78Å; Y119-D127 HydrophobicContact CD2-CB 4.09Å; Y119-D127 HydrophobicContact CE2-CB 3.93Å
120	N	73.9	Confident	86.8	Confident	17 Å²	17	32.1 Å²	32.1	9%	0.091	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-102.7	100.9	173.6	-176	-15	0	0	0	109.4	F118 D122 N123 D124 D125 Y317	F118-N120 PolarHBondContact O-N 3.37Å; N120-D122 VanDerWaalsContact C-N 3.27Å; N120-D122 PolarHBondContact O-N 3.08Å; N120-D122 WeakPolarHBondContact OD1-CB 3.25Å; N120-D122 PolarHBondContact OD1-N 3.2Å; N120-N123 PolarHBondContact ND2-ND2 2.76Å; N120-N123 PolarHBondContact O-N 3.24Å; N120-D124 WeakPolarHBondContact O-CA 3.41Å; N120-D124 PolarHBondContact O-N 2.77Å; N120-D125 HydrophobicContact CB-CB 4.26Å; N120-D125 PolarHBondContact N-O 3.44Å; N120-D125 PolarHBondContact O-N 2.87Å; N120-Y317 PolarHBondContact ND2-O 3.31Å
121	Y	70.3	Confident	86.8	Confident	149 Å²	149	31.2 Å²	31.2	58%	0.584	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-30.9	-179.9	172.2	-95.7	0	0	0	114	F79 Y119 N123	F79-Y121 AromaticContact CD1-CD2 3.86Å; F79-Y121 HydrophobicContact CD1-CD2 3.86Å; F79-Y121 AromaticContact CE1-CD2 3.55Å; F79-Y121 HydrophobicContact CE1-CD2 3.55Å; F79-Y121 HydrophobicContact CE1-CE2 4.27Å; F79-Y121 AromaticContact CE1-CG 3.84Å; F79-Y121 HydrophobicContact CE1-CG 3.84Å; Y119-Y121 HydrophobicContact CE1-CD2 4.27Å; Y121-N123 PolarHBondContact O-N 3.48Å
122	D	69.2	Low	86.8	Confident	102 Å²	102	33 Å²	33	55%	0.545	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-19.8	-176.1	-66.2	-30.5	0	0	0	112.3	N120	N120-D122 VanDerWaalsContact C-N 3.27Å; N120-D122 PolarHBondContact O-N 3.08Å; N120-D122 WeakPolarHBondContact OD1-CB 3.25Å; N120-D122 PolarHBondContact OD1-N 3.2Å
123	N	72.3	Confident	86.8	Confident	36 Å²	36	30 Å²	30	19%	0.193	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-151.3	10.8	-168.7	71.5	29.2	0	0	0	115.1	N120 Y121 D125 R192	N120-N123 PolarHBondContact ND2-ND2 2.76Å; N120-N123 PolarHBondContact O-N 3.24Å; Y121-N123 PolarHBondContact O-N 3.48Å; N123-D125 PolarHBondContact O-N 3.45Å; N123-D125 WeakPolarHBondContact OD1-CB 3.48Å; N123-D125 PolarHBondContact OD1-N 3.19Å; N123-R192 VanDerWaalsContact O-CZ 3.25Å; N123-R192 PolarHBondContact O-NH1 3.13Å; N123-R192 VanDerWaalsContact O-NH1 3.08Å; N123-R192 PolarHBondContact O-NH2 2.89Å; N123-R192 PolarHBondContact OD1-NH2 3.15Å
124	D	73.8	Confident	86.9	Confident	47 Å²	47	31.1 Å²	31.1	25%	0.251	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	33	-177.3	-58.1	-52.8	0	0	0	114.7	Y119 N120	Y119-D124 HydrophobicContact CE2-CB 4.48Å; Y119-D124 PolarHBondContact OH-OD1 2.78Å; N120-D124 WeakPolarHBondContact O-CA 3.41Å; N120-D124 PolarHBondContact O-N 2.77Å
125	D	79.8	Confident	86.9	Confident	12 Å²	12	35.3 Å²	35.3	6%	0.064	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-81.6	143.7	172.5	-170.1	31.8	0	0	0	110.1	N120 N123 D127 R195	N120-D125 HydrophobicContact CB-CB 4.26Å; N120-D125 PolarHBondContact N-O 3.44Å; N120-D125 PolarHBondContact O-N 2.87Å; N123-D125 PolarHBondContact O-N 3.45Å; N123-D125 WeakPolarHBondContact OD1-CB 3.48Å; N123-D125 PolarHBondContact OD1-N 3.19Å; D125-D127 VanDerWaalsContact C-N 3.26Å; D125-D127 PolarHBondContact O-N 3.49Å; D125-R195 IonicContact OD1-CZ 3.05Å; D125-R195 IonicContact OD1-NE 2.78Å; D125-R195 IonicContact OD1-NH1 3.99Å; D125-R195 PolarHBondContact OD1-NH1 2.74Å; D125-R195 VanDerWaalsContact OD1-NH1 3.14Å; D125-R195 IonicContact OD1-NH2 3.38Å; D125-R195 PolarHBondContact OD1-NH2 2.84Å; D125-R195 IonicContact OD2-CZ 3.28Å; D125-R195 IonicContact OD2-NH1 3.1Å; D125-R195 PolarHBondContact OD2-NH1 3.01Å; D125-R195 IonicContact OD2-NH2 3.86Å; D125-R195 PolarHBondContact OD2-NH2 2.93Å
126	N	86.1	Confident	87	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	35.1	-173.5	-57.6	-42.2	0	0	0	114.4	Y117 F118 I128 R195	Y117-N126 HydrophobicContact CD1-CB 3.79Å; Y117-N126 HydrophobicContact CE1-CB 4.44Å; Y117-N126 WeakPolarHBondContact O-CB 3.37Å; F118-N126 PolarHBondContact O-ND2 3.13Å; N126-I128 PolarHBondContact O-N 3.15Å; N126-R195 VanDerWaalsContact CG-NH1 3.28Å; N126-R195 PolarHBondContact ND2-NH1 3.1Å; N126-R195 WeakPolarHBondContact OD1-CD 3.49Å; N126-R195 PolarHBondContact OD1-NH1 3.36Å
127	D	91.6	Very high	87.2	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.168	C	C	.	.			trans	-73.3	64.6	-177.5	-172.2	21.2	0	0	0	113.2	A74 A75 H76 Y119 D125 S232 I249	A74-D127 WeakPolarHBondContact CA-O 3.35Å; A75-D127 WeakPolarHBondContact CA-OD1 3.31Å; A75-D127 PolarHBondContact N-OD1 3.33Å; H76-D127 IonicContact CE1-OD2 3.23Å; H76-D127 IonicContact CG-OD1 3.88Å; H76-D127 IonicContact CG-OD2 3.42Å; H76-D127 PolarHBondContact N-OD1 2.83Å; H76-D127 IonicContact ND1-OD1 2.75Å; H76-D127 PolarHBondContact ND1-OD1 3.1Å; H76-D127 IonicContact ND1-OD2 2.71Å; H76-D127 PolarHBondContact ND1-OD2 3.17Å; Y119-D127 HydrophobicContact CD2-CB 4.09Å; Y119-D127 HydrophobicContact CE2-CB 3.93Å; D125-D127 VanDerWaalsContact C-N 3.26Å; D125-D127 PolarHBondContact O-N 3.49Å; D127-S232 WeakPolarHBondContact CB-OG 3.29Å; D127-S232 WeakPolarHBondContact OD2-CA 3.37Å; D127-S232 WeakPolarHBondContact OD2-CB 3.46Å; D127-S232 PolarHBondContact OD2-OG 2.92Å; D127-I249 HydrophobicContact CB-CD1 3.93Å; D127-I249 HydrophobicContact CB-CG1 3.93Å; D127-I249 VanDerWaalsContact O-CG1 3.32Å; D127-I249 WeakPolarHBondContact O-CG1 3.44Å
128	I	94.9	Very high	87.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.18	C	C	.	.			trans	-138.7	135.2	-178.3	-172.3	172.8	0	0	0	111.6	V72 Y117 N126 I230 I249 F254 W257 I258	V72-I128 HydrophobicContact CG2-CD1 4.09Å; V72-I128 HydrophobicContact CG2-CG1 4.05Å; Y117-I128 PolarHBondContact N-O 2.97Å; N126-I128 PolarHBondContact O-N 3.15Å; I128-I230 HydrophobicContact CB-CD1 4.49Å; I128-I230 HydrophobicContact CD1-CD1 3.6Å; I128-I230 HydrophobicContact CG1-CD1 3.73Å; I128-I249 HydrophobicContact CB-CG2 4.35Å; I128-F254 HydrophobicContact CD1-CB 4.08Å; I128-F254 HydrophobicContact CD1-CG 4.3Å; I128-F254 HydrophobicContact CG2-CD1 3.95Å; I128-F254 HydrophobicContact CG2-CE1 4.1Å; I128-F254 HydrophobicContact CG2-CG 4.37Å; I128-W257 HydrophobicContact CB-CZ3 4.46Å; I128-W257 HydrophobicContact CD1-CE3 4.36Å; I128-W257 HydrophobicContact CD1-CZ3 3.85Å; I128-W257 HydrophobicContact CG1-CH2 4.49Å; I128-W257 HydrophobicContact CG1-CZ3 3.85Å; I128-W257 HydrophobicContact CG2-CE3 4.37Å; I128-W257 HydrophobicContact CG2-CH2 4.29Å; I128-W257 HydrophobicContact CG2-CZ3 3.87Å; I128-I258 HydrophobicContact CD1-CD1 4.04Å; I128-I258 HydrophobicContact CD1-CG1 4.24Å
129	T	96.7	Very high	88.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	144.4	175.3	-69.5	0	0	0	0	110.6	T73 A75 V78 Y114 V115 S116 L131	T73-T129 PolarHBondContact N-O 3.28Å; T73-T129 PolarHBondContact O-N 2.95Å; A75-T129 WeakPolarHBondContact CA-OG1 3.32Å; A75-T129 VanDerWaalsContact CB-OG1 3.28Å; A75-T129 WeakPolarHBondContact CB-OG1 3.14Å; V78-T129 HydrophobicContact CG2-CG2 3.96Å; Y114-T129 HydrophobicContact CD2-CG2 3.81Å; Y114-T129 HydrophobicContact CG-CG2 4.24Å; V115-T129 WeakPolarHBondContact O-CA 3.48Å; S116-T129 VanDerWaalsContact CB-OG1 3.23Å; S116-T129 WeakPolarHBondContact CB-OG1 3.16Å; S116-T129 PolarHBondContact OG-OG1 2.81Å; T129-L131 HydrophobicContact CG2-CD2 3.79Å
130	L	98.3	Very high	89.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.4	167.4	-59.5	-176.1	0	0	0	109.6	I70 V71 V72 Y114 V115 W257 I258 I262 L265	I70-L130 HydrophobicContact CG2-CD2 4.47Å; V71-L130 CarbonylContact O-C 3.58Å; V71-L130 WeakPolarHBondContact O-CA 3.38Å; V72-L130 HydrophobicContact CB-CD2 3.64Å; V72-L130 HydrophobicContact CG2-CD2 3.68Å; Y114-L130 CarbonylContact C-O 3.55Å; Y114-L130 WeakPolarHBondContact CA-O 3.37Å; Y114-L130 WeakPolarHBondContact CB-O 3.3Å; V115-L130 HydrophobicContact CG1-CB 4.19Å; V115-L130 PolarHBondContact N-O 2.88Å; V115-L130 PolarHBondContact O-N 2.95Å; L130-W257 HydrophobicContact CG-CH2 4.06Å; L130-W257 HydrophobicContact CG-CZ3 4.09Å; L130-I258 HydrophobicContact CD1-CB 4.41Å; L130-I258 HydrophobicContact CD1-CG2 3.97Å; L130-I258 HydrophobicContact CD2-CG1 4.47Å; L130-I258 HydrophobicContact CD2-CG2 4.21Å; L130-I262 HydrophobicContact CD1-CG1 3.99Å; L130-L265 HydrophobicContact CB-CD1 3.85Å
131	L	98.5	Very high	90.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	137.1	170.6	-44	176.6	0	0	0	108.5	L44 I70 V71 T73 V78 I90 V111 Y114 T129	L44-L131 HydrophobicContact CD1-CD1 4.01Å; L44-L131 HydrophobicContact CD2-CD1 3.84Å; I70-L131 WeakPolarHBondContact CA-O 3.26Å; V71-L131 HydrophobicContact CB-CB 4.22Å; V71-L131 HydrophobicContact CB-CD1 4.49Å; V71-L131 HydrophobicContact CG1-CD1 4.49Å; V71-L131 PolarHBondContact N-O 3.36Å; V71-L131 PolarHBondContact O-N 2.89Å; T73-L131 HydrophobicContact CG2-CD1 4.02Å; T73-L131 HydrophobicContact CG2-CD2 4.41Å; T73-L131 HydrophobicContact CG2-CG 4.07Å; V78-L131 HydrophobicContact CG1-CD2 3.93Å; I90-L131 HydrophobicContact CD1-CD2 4.42Å; I90-L131 HydrophobicContact CG2-CD1 4.24Å; V111-L131 HydrophobicContact CG1-CB 4.04Å; V111-L131 HydrophobicContact CG1-CD2 4.42Å; V111-L131 HydrophobicContact CG2-CB 4.29Å; V111-L131 HydrophobicContact CG2-CD1 4.21Å; Y114-L131 HydrophobicContact CD1-CD2 4.36Å; Y114-L131 HydrophobicContact CG-CD2 4.07Å; T129-L131 HydrophobicContact CG2-CD2 3.79Å
132	R	98.2	Very high	91.6	Very high	39 Å²	39	39.3 Å²	39.3	15%	0.147	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	119.8	163.8	-173.1	173.8	-177.5	-157.3	-2.9	108.6	D69 I70 V111 R112 N113 L265 K266	D69-R132 HydrophobicContact CB-CG 4.37Å; D69-R132 CarbonylContact O-C 3.57Å; D69-R132 VanDerWaalsContact O-CA 3.31Å; D69-R132 WeakPolarHBondContact O-CA 3.49Å; D69-R132 IonicContact OD2-CZ 3.14Å; D69-R132 IonicContact OD2-NE 3.44Å; D69-R132 PolarHBondContact OD2-NE 2.96Å; D69-R132 IonicContact OD2-NH2 3.27Å; D69-R132 PolarHBondContact OD2-NH2 2.84Å; I70-R132 HydrophobicContact CD1-CB 4.21Å; I70-R132 HydrophobicContact CD1-CG 4.16Å; V111-R132 CarbonylContact C-O 3.53Å; V111-R132 WeakPolarHBondContact CG1-O 3.46Å; R112-R132 HydrophobicContact CB-CG 4.45Å; R112-R132 WeakPolarHBondContact CB-O 2.99Å; R112-R132 PolarHBondContact N-O 3.42Å; N113-R132 PolarHBondContact O-N 3.45Å; N113-R132 WeakPolarHBondContact OD1-CB 3.4Å; R132-L265 HydrophobicContact CB-CB 4.28Å; R132-L265 HydrophobicContact CB-CD1 4.35Å; R132-L265 WeakPolarHBondContact CD-O 3.28Å; R132-L265 PolarHBondContact NH1-O 2.84Å; R132-K266 PolarHBondContact NH1-O 3.04Å
133	L	98.6	Very high	92.9	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	153.2	176.3	-59	172.6	0	0	0	110.5	L59 D69 V71 A92 L109 G110 E135 V137	L59-L133 HydrophobicContact CD2-CD1 4.18Å; D69-L133 HydrophobicContact CB-CB 4.36Å; D69-L133 WeakPolarHBondContact O-CG 3.32Å; D69-L133 PolarHBondContact O-N 2.97Å; V71-L133 HydrophobicContact CG2-CD1 3.95Å; V71-L133 HydrophobicContact CG2-CD2 3.88Å; V71-L133 HydrophobicContact CG2-CG 3.97Å; A92-L133 HydrophobicContact CB-CD2 3.48Å; A92-L133 VanDerWaalsContact CB-CD2 3.48Å; L109-L133 HydrophobicContact CB-CD2 4.14Å; L109-L133 HydrophobicContact CD1-CD1 4.16Å; G110-L133 CarbonylContact O-C 3.42Å; G110-L133 WeakPolarHBondContact O-CA 3.41Å; L133-E135 WeakPolarHBondContact CB-O 3.14Å; L133-E135 PolarHBondContact O-N 2.78Å; L133-V137 HydrophobicContact CD1-CG1 4.04Å
134	S	97.4	Very high	94.1	Very high	30 Å²	30	33.6 Å²	33.6	21%	0.21	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	-32	179.1	52.1	0	0	0	0	113.3	G110 E272	G110-S134 PolarHBondContact N-OG 2.8Å; G110-S134 PolarHBondContact O-N 2.85Å; G110-S134 PolarHBondContact O-OG 3.39Å; S134-E272 WeakPolarHBondContact CB-OE1 3.48Å; S134-E272 WeakPolarHBondContact CB-OE2 3.02Å; S134-E272 PolarHBondContact OG-OE1 2.78Å
135	E	96.9	Very high	95.2	Very high	119 Å²	119	31.3 Å²	31.3	56%	0.556	15%	0.154	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-135.8	154.2	170.8	61	180	-173.8	0	0	112.4	L109 L133	L109-E135 HydrophobicContact CD2-CG 3.36Å; L133-E135 WeakPolarHBondContact CB-O 3.14Å; L133-E135 PolarHBondContact O-N 2.78Å
136	P	97.2	Very high	96.1	Very high	46 Å²	46	30.8 Å²	30.8	30%	0.299	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	138.8	177	-16.5	31.1	0	0	0	112.9	M64 Q67 T68 D69	M64-P136 HydrophobicContact CE-CB 4.31Å; M64-P136 HydrophobicContact CE-CG 3.8Å; M64-P136 HydrophobicContact SD-CB 4.26Å; M64-P136 HydrophobicContact SD-CG 4.24Å; Q67-P136 HydrophobicContact CB-CB 4.23Å; Q67-P136 HydrophobicContact CG-CB 4.06Å; Q67-P136 VanDerWaalsContact NE2-CB 3.27Å; T68-P136 CarbonylContact O-C 3.33Å; T68-P136 WeakPolarHBondContact O-CA 3.44Å; D69-P136 HydrophobicContact CB-CB 4.28Å; D69-P136 HydrophobicContact CB-CG 4.35Å
137	V	96.5	Very high	96.6	Very high	9 Å²	9	31 Å²	31	6%	0.055	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	128	173.5	-60.9	0	0	0	0	111.2	L59 Q67 T68 V94 L109 L133 V143	L59-V137 HydrophobicContact CD1-CG2 4.03Å; L59-V137 HydrophobicContact CD2-CG2 3.79Å; Q67-V137 CarbonylContact C-O 3.57Å; Q67-V137 WeakPolarHBondContact CA-O 3.31Å; Q67-V137 VanDerWaalsContact CB-O 3.24Å; Q67-V137 WeakPolarHBondContact CB-O 3.48Å; T68-V137 HydrophobicContact CG2-CG2 4.01Å; T68-V137 PolarHBondContact N-O 3.36Å; T68-V137 VanDerWaalsContact N-O 3.07Å; T68-V137 VanDerWaalsContact O-CG2 3.26Å; T68-V137 WeakPolarHBondContact O-CG2 3.45Å; T68-V137 PolarHBondContact O-N 3.15Å; V94-V137 HydrophobicContact CG2-CG1 3.91Å; L109-V137 HydrophobicContact CD1-CG1 3.3Å; L109-V137 HydrophobicContact CD2-CG1 3.96Å; L109-V137 HydrophobicContact CG-CG1 4.27Å; L133-V137 HydrophobicContact CD1-CG1 4.04Å; V137-V143 HydrophobicContact CB-CG1 4.17Å; V137-V143 HydrophobicContact CG2-CG1 3.88Å
138	Q	96	Very high	96.8	Very high	98 Å²	98	32.1 Å²	32.1	46%	0.458	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	139.5	178	-66.1	-62.9	-27.3	0	0	111.5	N66 T140	N66-Q138 PolarHBondContact O-OE1 2.02Å; Q138-T140 PolarHBondContact O-N 2.86Å
139	Y	95.5	Very high	96.8	Very high	24 Å²	24	32.1 Å²	32.1	9%	0.094	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-72.1	123.2	174.5	-60	-14.2	0	0	0	110.3	D61 N66 Q67 T68 V143 P145	D61-Y139 PolarHBondContact OD1-OH 3.28Å; N66-Y139 VanDerWaalsContact C-CD2 3.47Å; N66-Y139 WeakPolarHBondContact O-CB 3.49Å; N66-Y139 PolarHBondContact O-N 2.89Å; Q67-Y139 VanDerWaalsContact C-CZ 3.43Å; Q67-Y139 PolarHBondContact O-OH 2.57Å; Q67-Y139 VanDerWaalsContact O-OH 3.11Å; T68-Y139 WeakPolarHBondContact CB-OH 3.23Å; T68-Y139 HydrophobicContact CG2-CE1 3.83Å; Y139-V143 CarbonylContact C-O 3.57Å; Y139-V143 VanDerWaalsContact CA-O 3.27Å; Y139-V143 WeakPolarHBondContact CA-O 3.29Å; Y139-P145 VanDerWaalsContact CE1-CD 3.45Å; Y139-P145 HydrophobicContact CE1-CG 4Å; Y139-P145 HydrophobicContact CE2-CG 4.03Å; Y139-P145 VanDerWaalsContact CZ-CD 3.47Å; Y139-P145 WeakPolarHBondContact OH-CG 3.15Å
140	T	95.3	Very high	96.5	Very high	71 Å²	71	34.4 Å²	34.4	44%	0.436	17%	0.173	S	C	.	.			trans	-132.2	-175.2	178.3	70.7	0	0	0	0	109.9	Q138 Y142 V143	Q138-T140 PolarHBondContact O-N 2.86Å; T140-Y142 PolarHBondContact O-N 2.88Å; T140-Y142 PolarHBondContact OG1-N 2.89Å; T140-V143 PolarHBondContact N-O 2.87Å; T140-V143 VanDerWaalsContact O-O 3.06Å; T140-V143 PolarHBondContact OG1-N 2.88Å
141	K	94.7	Very high	95.9	Very high	115 Å²	115	39.7 Å²	39.7	50%	0.5	20%	0.201	S	C	.	.	S	Bend	trans	-67	-12.1	170	70.4	-170.6	-174.4	-174.4	0	113.5	A12	A12-K141 HydrophobicContact CB-CB 3.88Å
142	Y	95.9	Very high	95.1	Very high	76 Å²	76	47.8 Å²	47.8	30%	0.298	24%	0.237	S	C	.	.	S	Bend	trans	-108.2	-23.3	-177.2	-51	-57.9	0	0	0	113.5	H36 P39 T140	H36-Y142 HydrophobicContact CB-CD1 3.66Å; H36-Y142 HydrophobicContact CB-CE1 4.47Å; H36-Y142 AromaticContact CD2-CD1 3.52Å; H36-Y142 AromaticContact CD2-CE1 3.58Å; H36-Y142 AromaticContact CG-CD1 3.36Å; H36-Y142 AromaticContact CG-CE1 3.93Å; H36-Y142 AromaticContact ND1-CD1 3.75Å; H36-Y142 AromaticContact NE2-CE1 3.91Å; P39-Y142 WeakPolarHBondContact CA-O 3.38Å; P39-Y142 VanDerWaalsContact CB-O 3.25Å; P39-Y142 WeakPolarHBondContact CB-O 3.39Å; T140-Y142 PolarHBondContact O-N 2.88Å; T140-Y142 PolarHBondContact OG1-N 2.89Å
143	V	96.8	Very high	94.4	Very high	6 Å²	6	47 Å²	47	4%	0.036	24%	0.236	C	C	.	.			trans	-134.5	119.5	-173.5	180	0	0	0	0	108.8	P39 L59 V94 V137 Y139 T140	P39-V143 WeakPolarHBondContact O-CA 3.04Å; L59-V143 HydrophobicContact CD1-CG1 3.51Å; V94-V143 HydrophobicContact CB-CG2 4.36Å; V94-V143 HydrophobicContact CG2-CG1 4.41Å; V94-V143 HydrophobicContact CG2-CG2 4.11Å; V137-V143 HydrophobicContact CB-CG1 4.17Å; V137-V143 HydrophobicContact CG2-CG1 3.88Å; Y139-V143 CarbonylContact C-O 3.57Å; Y139-V143 VanDerWaalsContact CA-O 3.27Å; Y139-V143 WeakPolarHBondContact CA-O 3.29Å; T140-V143 PolarHBondContact N-O 2.87Å; T140-V143 VanDerWaalsContact O-O 3.06Å; T140-V143 PolarHBondContact OG1-N 2.88Å
144	S	96.8	Very high	93.6	Very high	12 Å²	12	47 Å²	47	8%	0.084	24%	0.236	C	C	.	.			trans	-166.6	148.9	176.4	69.3	0	0	0	0	110.2	P39 W40	P39-S144 CarbonylContact C-O 3.52Å; P39-S144 VanDerWaalsContact C-O 3.25Å; P39-S144 WeakPolarHBondContact CG-OG 3.48Å; P39-S144 PolarHBondContact O-N 2.9Å; W40-S144 WeakPolarHBondContact CA-O 3.07Å; W40-S144 WeakPolarHBondContact CB-O 3.34Å; W40-S144 PolarHBondContact N-O 2.91Å; W40-S144 VanDerWaalsContact N-O 3.16Å
145	P	97.9	Very high	92.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-78.1	156.3	-168.5	33.9	-38.5	0	0	0	112.7	C8 G9 L59 D61 Y139	C8-P145 WeakPolarHBondContact CA-O 3.24Å; C8-P145 HydrophobicContact CB-CG 4.11Å; G9-P145 PolarHBondContact N-O 3.06Å; L59-P145 HydrophobicContact CB-CB 4.48Å; L59-P145 CarbonylContact O-C 3.46Å; L59-P145 VanDerWaalsContact O-CA 3.26Å; L59-P145 WeakPolarHBondContact O-CA 3.42Å; L59-P145 WeakPolarHBondContact O-CB 3.29Å; D61-P145 HydrophobicContact CB-CB 4.27Å; D61-P145 HydrophobicContact CB-CG 4.06Å; Y139-P145 VanDerWaalsContact CE1-CD 3.45Å; Y139-P145 HydrophobicContact CE1-CG 4Å; Y139-P145 HydrophobicContact CE2-CG 4.03Å; Y139-P145 VanDerWaalsContact CZ-CD 3.47Å; Y139-P145 WeakPolarHBondContact OH-CG 3.15Å
146	I	98	Very high	91.5	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-84.9	152.2	164.2	-166.5	165.1	0	0	0	110	W40 L59 V60 F218 Y225 L227	W40-I146 HydrophobicContact CB-CB 3.87Å; W40-I146 HydrophobicContact CB-CG2 4.29Å; W40-I146 HydrophobicContact CD2-CB 3.92Å; W40-I146 HydrophobicContact CD2-CD1 4.31Å; W40-I146 HydrophobicContact CD2-CG1 4.34Å; W40-I146 HydrophobicContact CE3-CB 4.28Å; W40-I146 HydrophobicContact CG-CB 3.73Å; W40-I146 HydrophobicContact CG-CD1 4.46Å; W40-I146 HydrophobicContact CG-CG2 4.38Å; W40-I146 HydrophobicContact CZ2-CD1 4.47Å; L59-I146 WeakPolarHBondContact O-CG2 3.48Å; L59-I146 PolarHBondContact O-N 2.84Å; V60-I146 HydrophobicContact CG1-CG2 4.15Å; I146-F218 HydrophobicContact CD1-CB 3.39Å; I146-F218 HydrophobicContact CD1-CG 4.17Å; I146-Y225 WeakPolarHBondContact CG1-O 3.34Å; I146-L227 HydrophobicContact CD1-CB 3.99Å; I146-L227 HydrophobicContact CD1-CD1 4.45Å; I146-L227 HydrophobicContact CG1-CB 4.24Å; I146-L227 HydrophobicContact CG2-CB 3.86Å; I146-L227 HydrophobicContact CG2-CD2 4.38Å
147	C	97	Very high	90.4	Very high	4 Å²	4	53.5 Å²	53.5	3%	0.027	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-76.1	139	175.8	-60.1	0	0	0	0	111.4	C8 Y225 Y226 L227	C8-C147 HydrophobicContact CB-CB 4.02Å; C8-C147 WeakPolarHBondContact CB-SG 3.13Å; C8-C147 PolarHBondContact O-SG 3.17Å; C8-C147 WeakPolarHBondContact SG-CA 3.45Å; C8-C147 WeakPolarHBondContact SG-CB 3.27Å; C8-C147 CovalentContact SG-SG 2.05Å; C8-C147 PolarHBondContact SG-SG 2.82Å; C147-Y225 WeakPolarHBondContact CB-O 3.41Å; C147-Y225 PolarHBondContact N-O 3.09Å; C147-Y226 HydrophobicContact CB-CD1 3.3Å; C147-Y226 HydrophobicContact CB-CE1 3.45Å; C147-Y226 VanDerWaalsContact CB-CE1 3.45Å; C147-Y226 HydrophobicContact CB-CG 3.91Å; C147-Y226 CarbonylContact O-C 3.55Å; C147-Y226 VanDerWaalsContact O-CA 3.3Å; C147-Y226 WeakPolarHBondContact O-CA 3.34Å; C147-L227 PolarHBondContact O-N 3.04Å
148	L	96.9	Very high	89.6	Confident	23 Å²	23	54.8 Å²	54.8	12%	0.12	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-73.4	133.5	166.8	-71	173.8	0	0	0	109.8	V60 V251 Y255 I258 M259	V60-L148 HydrophobicContact CB-CD2 4.34Å; V60-L148 HydrophobicContact CB-CG 4.3Å; V60-L148 HydrophobicContact CG1-CD2 3.78Å; V60-L148 HydrophobicContact CG1-CG 4.18Å; L148-V251 HydrophobicContact CD2-CG1 4.09Å; L148-Y255 HydrophobicContact CB-CD2 4.08Å; L148-Y255 HydrophobicContact CB-CE2 3.92Å; L148-I258 HydrophobicContact CD1-CG2 3.67Å; L148-I258 HydrophobicContact CD2-CD1 4.07Å; L148-I258 HydrophobicContact CD2-CG2 4.4Å; L148-M259 HydrophobicContact CD1-SD 4.13Å
149	P	94.6	Very high	88.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-77.3	149.4	175.7	35.1	-39	0	0	0	111.1	T153 S154 L227 F228 V251 D252 Y255	P149-T153 WeakPolarHBondContact CA-OG1 3.38Å; P149-S154 WeakPolarHBondContact CB-OG 3.5Å; P149-L227 WeakPolarHBondContact CD-O 3.43Å; P149-L227 WeakPolarHBondContact CG-O 3.32Å; P149-F228 HydrophobicContact CB-CD2 4.38Å; P149-F228 HydrophobicContact CB-CE2 4.48Å; P149-V251 HydrophobicContact CG-CB 3.88Å; P149-V251 HydrophobicContact CG-CG1 3.92Å; P149-D252 HydrophobicContact CB-CB 4.27Å; P149-D252 HydrophobicContact CG-CB 4.14Å; P149-Y255 WeakPolarHBondContact O-CD2 3.45Å
150	T	90.7	Very high	88.1	Confident	48 Å²	48	59.6 Å²	59.6	29%	0.294	31%	0.313	S	S	.	.			trans	-106.7	169.4	165.6	64	0	0	0	0	109.9	F152 T153 S154 Y255	T150-F152 PolarHBondContact O-N 3.18Å; T150-F152 PolarHBondContact OG1-N 3.44Å; T150-T153 PolarHBondContact N-OG1 3.13Å; T150-T153 PolarHBondContact O-N 3.02Å; T150-T153 PolarHBondContact O-OG1 2.81Å; T150-T153 PolarHBondContact OG1-N 2.93Å; T150-S154 WeakPolarHBondContact O-CB 3.41Å; T150-S154 PolarHBondContact O-N 2.83Å; T150-S154 PolarHBondContact O-OG 3.06Å; T150-Y255 HydrophobicContact CG2-CD2 4.26Å; T150-Y255 HydrophobicContact CG2-CE2 3.91Å
151	N	85.3	Confident	87.9	Confident	112 Å²	112	56.2 Å²	56.2	60%	0.599	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-27.9	171.6	-74.9	-30.9	0	0	0	112.8	K155 D252	N151-K155 PolarHBondContact O-N 3.23Å; N151-D252 PolarHBondContact OD1-OD2 3.44Å
152	F	80.8	Confident	87.8	Confident	170 Å²	170	51.4 Å²	51.4	75%	0.746	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-50.1	177.7	-177	-93.5	0	0	0	111.5	T150 S154 K155	T150-F152 PolarHBondContact O-N 3.18Å; T150-F152 PolarHBondContact OG1-N 3.44Å; F152-S154 VanDerWaalsContact C-N 3.26Å; F152-S154 PolarHBondContact O-N 3.17Å; F152-K155 WeakPolarHBondContact O-CB 3.42Å; F152-K155 PolarHBondContact O-N 3.5Å
153	T	83.2	Confident	87.6	Confident	21 Å²	21	47.9 Å²	47.9	13%	0.129	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-30.8	179.2	55.9	0	0	0	0	112	P149 T150 Y226 F228	P149-T153 WeakPolarHBondContact CA-OG1 3.38Å; T150-T153 PolarHBondContact N-OG1 3.13Å; T150-T153 PolarHBondContact O-N 3.02Å; T150-T153 PolarHBondContact O-OG1 2.81Å; T150-T153 PolarHBondContact OG1-N 2.93Å; T153-Y226 HydrophobicContact CG2-CD1 4.35Å; T153-Y226 HydrophobicContact CG2-CE1 3.91Å; T153-F228 WeakPolarHBondContact O-CZ 3.25Å
154	S	81.6	Confident	87.4	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.014	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	0.7	-179.1	-64.7	0	0	0	0	114.9	P149 T150 F152 S156 D252	P149-S154 WeakPolarHBondContact CB-OG 3.5Å; T150-S154 WeakPolarHBondContact O-CB 3.41Å; T150-S154 PolarHBondContact O-N 2.83Å; T150-S154 PolarHBondContact O-OG 3.06Å; F152-S154 VanDerWaalsContact C-N 3.26Å; F152-S154 PolarHBondContact O-N 3.17Å; S154-S156 VanDerWaalsContact C-N 3.3Å; S154-S156 PolarHBondContact O-N 2.93Å; S154-D252 VanDerWaalsContact CB-OD2 3.32Å; S154-D252 WeakPolarHBondContact CB-OD2 3.01Å
155	K	77.2	Confident	87.1	Confident	171 Å²	171	47.4 Å²	47.4	74%	0.743	26%	0.256	S	S	*	.	S	Bend	trans	-64.3	-36	-177	-171.3	177.3	179.1	-176.6	0	112.5	N151 F152	N151-K155 PolarHBondContact O-N 3.23Å; F152-K155 WeakPolarHBondContact O-CB 3.42Å; F152-K155 PolarHBondContact O-N 3.5Å
156	S	74.9	Confident	86.7	Confident	99 Å²	99	47.9 Å²	47.9	69%	0.692	26%	0.257	S	S	*	.	S	Bend	trans	-132	82.7	176.7	-64.6	0	0	0	0	108.2	S154	S154-S156 VanDerWaalsContact C-N 3.3Å; S154-S156 PolarHBondContact O-N 2.93Å
157	P	73.5	Confident	85.9	Confident	61 Å²	61	48 Å²	48	40%	0.396	26%	0.26	S	S	.	.			trans	-56.3	139.1	174.9	22.9	-31.5	0	0	0	109.7	P184 F228	P157-P184 HydrophobicContact CB-CB 4.44Å; P157-P184 HydrophobicContact CB-CG 4.28Å; P157-F228 HydrophobicContact CB-CD1 4.1Å; P157-F228 HydrophobicContact CB-CE1 3.67Å
158	P	79	Confident	84.5	Confident	37 Å²	37	53.2 Å²	53.2	24%	0.24	28%	0.282	C	S	.	.			trans	-54.9	150.4	169	-24.6	34.4	0	0	0	111.5	A160 C219 E220 V221	P158-A160 PolarHBondContact O-N 2.82Å; P158-C219 HydrophobicContact CG-CB 3.9Å; P158-E220 VanDerWaalsContact CG-O 3.23Å; P158-E220 WeakPolarHBondContact CG-O 3.4Å; P158-V221 HydrophobicContact CG-CG2 4.14Å
159	E	75.9	Confident	82.9	Confident	176 Å²	176	53.7 Å²	53.7	82%	0.822	29%	0.286	S	S	*	.	S	Bend	trans	-61.7	-30.5	177.2	-67.1	-175.5	169.2	0	0	112.6	T183	E159-T183 WeakPolarHBondContact O-CG2 3.28Å; E159-T183 PolarHBondContact O-OG1 3.33Å; E159-T183 VanDerWaalsContact O-OG1 3.04Å
160	A	85.1	Confident	81.1	Confident	47 Å²	47	59.2 Å²	59.2	39%	0.388	31%	0.31	S	S	.	.			trans	-117.3	114.2	177.9	0	0	0	0	0	110.1	P158 V181	P158-A160 PolarHBondContact O-N 2.82Å; A160-V181 HydrophobicContact CB-CG1 3.92Å
161	C	91	Very high	79.4	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	175	164.9	-61	0	0	0	0	108.9	V181 N182 P184 L217 F218 C219	C161-V181 CarbonylContact O-C 3.57Å; C161-V181 WeakPolarHBondContact O-CA 3.1Å; C161-N182 CarbonylContact C-O 3.58Å; C161-N182 WeakPolarHBondContact CA-O 3.19Å; C161-N182 WeakPolarHBondContact CB-O 2.95Å; C161-N182 PolarHBondContact N-O 3.11Å; C161-N182 PolarHBondContact O-N 2.79Å; C161-P184 HydrophobicContact CB-CG 4.02Å; C161-P184 WeakPolarHBondContact SG-CG 3.34Å; C161-L217 HydrophobicContact CB-CD1 3.87Å; C161-L217 HydrophobicContact CB-CG 4.17Å; C161-F218 CarbonylContact C-O 3.56Å; C161-F218 WeakPolarHBondContact CA-O 3.35Å; C161-F218 WeakPolarHBondContact CB-O 2.96Å; C161-C219 HydrophobicContact CB-CB 4.03Å; C161-C219 WeakPolarHBondContact CB-SG 3.33Å; C161-C219 WeakPolarHBondContact SG-CB 3.48Å; C161-C219 CovalentContact SG-SG 2.02Å; C161-C219 PolarHBondContact SG-SG 3.09Å
162	F	92.2	Very high	77.9	Confident	14 Å²	14	61 Å²	61	6%	0.061	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	137.9	-173.4	-55.7	-83	0	0	0	110.4	T17 W31 T180 V181 L217 F218 Y225	T17-F162 HydrophobicContact CG2-CE1 4.42Å; T17-F162 HydrophobicContact CG2-CE2 4.29Å; T17-F162 HydrophobicContact CG2-CZ 3.82Å; W31-F162 HydrophobicContact CH2-CD1 4.44Å; W31-F162 HydrophobicContact CH2-CE1 4.34Å; W31-F162 HydrophobicContact CZ2-CD1 4.41Å; W31-F162 HydrophobicContact CZ2-CE1 4.4Å; F162-T180 WeakPolarHBondContact CA-O 3.25Å; F162-V181 HydrophobicContact CD1-CG2 4.3Å; F162-V181 HydrophobicContact CE1-CG2 4.07Å; F162-L217 CarbonylContact O-C 3.56Å; F162-L217 WeakPolarHBondContact O-CA 3.46Å; F162-F218 HydrophobicContact CB-CD1 4.21Å; F162-F218 HydrophobicContact CB-CD2 4.01Å; F162-F218 HydrophobicContact CB-CE1 3.74Å; F162-F218 HydrophobicContact CB-CE2 3.51Å; F162-F218 HydrophobicContact CB-CG 4.34Å; F162-F218 HydrophobicContact CB-CZ 3.37Å; F162-F218 HydrophobicContact CD2-CD2 4.29Å; F162-F218 HydrophobicContact CD2-CE2 4.04Å; F162-F218 HydrophobicContact CG-CE2 4.05Å; F162-F218 HydrophobicContact CG-CZ 4.28Å; F162-F218 PolarHBondContact N-O 3.47Å; F162-F218 WeakPolarHBondContact O-CD1 3.36Å; F162-F218 WeakPolarHBondContact O-CE1 2.93Å; F162-F218 PolarHBondContact O-N 3.41Å; F162-Y225 HydrophobicContact CD2-CE1 4.29Å; F162-Y225 HydrophobicContact CE2-CE1 4.23Å
163	G	91	Very high	76.6	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	150.1	162.9	0	0	0	0	0	109.4	S179 T180 P216	G163-S179 CarbonylContact O-C 3.52Å; G163-S179 VanDerWaalsContact O-CA 3.25Å; G163-S179 WeakPolarHBondContact O-CA 3.33Å; G163-S179 PolarHBondContact O-OG 2.92Å; G163-T180 PolarHBondContact N-O 2.77Å; G163-T180 VanDerWaalsContact N-O 3.07Å; G163-T180 PolarHBondContact O-N 3.33Å; G163-P216 WeakPolarHBondContact CA-O 3.31Å
164	A	92	Very high	75.6	Confident	2 Å²	2	61.3 Å²	61.3	2%	0.017	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	146.8	173.5	0	0	0	0	0	112.9	L38 M41 L177 R178 S215 F218	L38-A164 HydrophobicContact CD1-CB 3.5Å; L38-A164 VanDerWaalsContact CD1-CB 3.5Å; M41-A164 WeakPolarHBondContact CE-O 3.42Å; M41-A164 HydrophobicContact SD-CB 4.13Å; A164-L177 HydrophobicContact CB-CD1 4.3Å; A164-R178 WeakPolarHBondContact CA-O 3.47Å; A164-R178 VanDerWaalsContact CB-O 3.25Å; A164-R178 WeakPolarHBondContact CB-O 3.15Å; A164-S215 WeakPolarHBondContact O-CB 3.49Å; A164-F218 HydrophobicContact CB-CE1 3.86Å; A164-F218 HydrophobicContact CB-CZ 4.35Å
165	G	91.5	Very high	75.5	Confident	6 Å²	6	63.8 Å²	63.8	6%	0.062	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.3	-174.5	178.9	0	0	0	0	0	114	R178 D212	G165-R178 PolarHBondContact N-O 2.75Å; G165-R178 VanDerWaalsContact N-O 3.14Å; G165-R178 PolarHBondContact O-N 2.83Å; G165-D212 VanDerWaalsContact CA-OD1 3.24Å; G165-D212 WeakPolarHBondContact CA-OD1 3.13Å
166	W	89.8	Confident	75.9	Confident	10 Å²	10	58.4 Å²	58.4	4%	0.038	31%	0.313	C	S	.	.			trans	-115.5	11.5	-178.6	-63.6	-91.6	0	0	0	112.5	M41 Y43 A96 H97 V99 L175 L177 D212	M41-W166 HydrophobicContact CB-CH2 3.51Å; M41-W166 HydrophobicContact CB-CZ2 4.38Å; M41-W166 HydrophobicContact CB-CZ3 4.01Å; M41-W166 HydrophobicContact CE-CE3 4.13Å; M41-W166 HydrophobicContact CE-CH2 4.17Å; M41-W166 HydrophobicContact CE-CZ3 3.57Å; M41-W166 HydrophobicContact CG-CH2 4.46Å; Y43-W166 HydrophobicContact CD2-CB 4.21Å; Y43-W166 HydrophobicContact CD2-CD2 4.03Å; Y43-W166 AromaticContact CD2-CE3 3.86Å; Y43-W166 HydrophobicContact CD2-CE3 3.86Å; Y43-W166 HydrophobicContact CD2-CG 4.22Å; Y43-W166 HydrophobicContact CD2-CZ3 4.44Å; Y43-W166 HydrophobicContact CE2-CB 4.2Å; A96-W166 HydrophobicContact CB-CZ2 4.35Å; H97-W166 PolarHBondContact O-NE1 3.04Å; V99-W166 HydrophobicContact CG1-CD2 4.35Å; V99-W166 HydrophobicContact CG1-CG 4.35Å; V99-W166 HydrophobicContact CG1-CZ2 4.34Å; V99-W166 HydrophobicContact CG2-CG 4.4Å; W166-L175 VanDerWaalsContact CD1-O 3.31Å; W166-L175 WeakPolarHBondContact O-CD2 3.38Å; W166-L177 HydrophobicContact CD2-CD1 3.99Å; W166-L177 HydrophobicContact CE3-CD1 4.21Å; W166-L177 HydrophobicContact CH2-CD1 4.21Å; W166-L177 HydrophobicContact CZ2-CB 4.19Å; W166-L177 HydrophobicContact CZ2-CD1 3.92Å; W166-L177 HydrophobicContact CZ2-CD2 4.26Å; W166-L177 HydrophobicContact CZ2-CG 4.34Å; W166-L177 HydrophobicContact CZ3-CD1 4.32Å; W166-D212 PolarHBondContact N-OD1 2.96Å
167	G	81.2	Confident	76.5	Confident	5 Å²	5	53.8 Å²	53.8	5%	0.052	28%	0.28	C	S	.	.			trans	-58.7	166.5	-176.3	0	0	0	0	0	113.8	T169 E210 D212	G167-T169 WeakPolarHBondContact O-CG2 3.06Å; G167-T169 PolarHBondContact O-N 2.99Å; G167-E210 CarbonylContact C-O 3.56Å; G167-E210 WeakPolarHBondContact CA-O 3.11Å; G167-D212 WeakPolarHBondContact CA-OD1 3.38Å; G167-D212 PolarHBondContact N-OD1 3.32Å
168	K	67.7	Low	77	Confident	113 Å²	113	52.7 Å²	52.7	49%	0.491	27%	0.268	S	S	.	.			trans	-53.4	138.3	-177.5	-72.7	-173.5	-177.7	169.8	0	110.9	E210	K168-E210 HydrophobicContact CD-CB 4.09Å; K168-E210 WeakPolarHBondContact CD-OE2 3.5Å; K168-E210 VanDerWaalsContact CE-OE2 3.22Å; K168-E210 WeakPolarHBondContact CE-OE2 3.33Å; K168-E210 HydrophobicContact CG-CB 4.28Å; K168-E210 PolarHBondContact N-O 3.33Å; K168-E210 IonicContact NZ-OE2 2.64Å; K168-E210 PolarHBondContact NZ-OE2 2.78Å
169	T	62.9	Low	77.3	Confident	33 Å²	33	51.4 Å²	51.4	20%	0.202	26%	0.26	C	S	.	.			trans	-130.3	155.5	177.6	88.3	0	0	0	0	109.1	G167 S171 R178	G167-T169 WeakPolarHBondContact O-CG2 3.06Å; G167-T169 PolarHBondContact O-N 2.99Å; T169-S171 CarbonylContact O-C 3.47Å; T169-S171 PolarHBondContact O-N 3.41Å; T169-S171 PolarHBondContact OG1-O 3.29Å; T169-R178 PolarHBondContact OG1-NH1 2.69Å; T169-R178 PolarHBondContact OG1-NH2 3.41Å
170	K	57.2	Low	77.7	Confident	116 Å²	116	43.5 Å²	43.5	50%	0.504	22%	0.224	S	C	.	.	S	Bend	trans	-53.5	-26.4	179.7	-59	-175.2	-161.7	170.7	0	113.3	V28 N205 D206	V28-K170 HydrophobicContact CG2-CD 4.14Å; K170-N205 PolarHBondContact NZ-O 2.92Å; K170-D206 WeakPolarHBondContact CE-OD1 3.5Å; K170-D206 IonicContact NZ-OD1 3.66Å
171	S	54.3	Low	77.6	Confident	43 Å²	43	42 Å²	42	30%	0.301	21%	0.21	S	C	.	.	S	Bend	trans	-100.4	95.5	170.9	-174.6	0	0	0	0	109.4	T169 T173	T169-S171 CarbonylContact O-C 3.47Å; T169-S171 PolarHBondContact O-N 3.41Å; T169-S171 PolarHBondContact OG1-O 3.29Å; S171-T173 PolarHBondContact O-N 3.08Å; S171-T173 PolarHBondContact OG-OG1 2.97Å
172	M	53.5	Low	77.2	Confident	153 Å²	153	42 Å²	42	75%	0.754	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	8.7	-179.3	-68.9	-67.9	-64.7	0	0	115.6
173	T	53.8	Low	76.8	Confident	97 Å²	97	43.8 Å²	43.8	60%	0.595	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-23.1	-159.4	54.8	0	0	0	0	115.7	S171	S171-T173 PolarHBondContact O-N 3.08Å; S171-T173 PolarHBondContact OG-OG1 2.97Å
174	K	63.2	Low	76.3	Confident	102 Å²	102	44.9 Å²	44.9	44%	0.443	23%	0.229	S	C	.	.			trans	-153	122.5	-178	-59	-171.7	-178.5	-177.2	0	112.3	D100 R176	D100-K174 WeakPolarHBondContact OD2-CA 3.24Å; K174-R176 HydrophobicContact CB-CG 4.32Å; K174-R176 PolarHBondContact O-N 2.68Å
175	L	79.7	Confident	75.6	Confident	54 Å²	54	47.3 Å²	47.3	28%	0.283	24%	0.241	S	C	.	.			trans	-81.2	68.2	172.8	-62.4	177.3	0	0	0	110.4	V99 D100 W166	V99-L175 HydrophobicContact CG2-CB 3.3Å; V99-L175 HydrophobicContact CG2-CD1 3.79Å; V99-L175 HydrophobicContact CG2-CG 4.18Å; V99-L175 WeakPolarHBondContact CG2-O 3.39Å; V99-L175 PolarHBondContact N-O 2.96Å; D100-L175 WeakPolarHBondContact OD1-CD1 3.46Å; D100-L175 PolarHBondContact OD2-N 3.06Å; W166-L175 VanDerWaalsContact CD1-O 3.31Å; W166-L175 WeakPolarHBondContact O-CD2 3.38Å
176	R	85.6	Confident	74.4	Confident	58 Å²	58	52.4 Å²	52.4	22%	0.219	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-96.7	141.4	171.3	-70.5	175.8	-178.2	168.2	-6.1	110.5	Q32 H97 D98 K174 R178	Q32-R176 HydrophobicContact CG-CB 4.14Å; Q32-R176 VanDerWaalsContact OE1-CD 3.3Å; H97-R176 WeakPolarHBondContact O-CA 3.33Å; D98-R176 HydrophobicContact CB-CG 3.94Å; D98-R176 WeakPolarHBondContact OD1-CG 3.35Å; D98-R176 IonicContact OD1-NE 3.89Å; D98-R176 IonicContact OD2-CZ 3.82Å; D98-R176 IonicContact OD2-NE 3.51Å; D98-R176 PolarHBondContact OD2-NE 3.16Å; D98-R176 IonicContact OD2-NH2 3.29Å; D98-R176 PolarHBondContact OD2-NH2 2.93Å; K174-R176 HydrophobicContact CB-CG 4.32Å; K174-R176 PolarHBondContact O-N 2.68Å; R176-R178 WeakPolarHBondContact O-CG 3.29Å; R176-R178 PolarHBondContact O-N 3.18Å
177	L	86.4	Confident	73.2	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	27%	0.274	C	S	.	.			trans	-56.6	128.2	176.5	-175	59.9	0	0	0	110.5	A33 L38 M41 H97 A164 W166	A33-L177 HydrophobicContact CB-CB 4.28Å; A33-L177 HydrophobicContact CB-CD2 4.19Å; A33-L177 HydrophobicContact CB-CG 3.96Å; A33-L177 WeakPolarHBondContact CB-O 3.41Å; A33-L177 PolarHBondContact N-O 2.93Å; L38-L177 HydrophobicContact CB-CD2 3.92Å; L38-L177 HydrophobicContact CD1-CD2 3.94Å; L38-L177 HydrophobicContact CD1-CG 4.28Å; L38-L177 HydrophobicContact CG-CD2 4.39Å; M41-L177 HydrophobicContact CB-CD2 4.38Å; M41-L177 HydrophobicContact CE-CD1 3.98Å; M41-L177 HydrophobicContact CG-CD1 4.15Å; M41-L177 HydrophobicContact CG-CD2 3.98Å; H97-L177 PolarHBondContact O-N 2.84Å; A164-L177 HydrophobicContact CB-CD1 4.3Å; W166-L177 HydrophobicContact CD2-CD1 3.99Å; W166-L177 HydrophobicContact CE3-CD1 4.21Å; W166-L177 HydrophobicContact CH2-CD1 4.21Å; W166-L177 HydrophobicContact CZ2-CB 4.19Å; W166-L177 HydrophobicContact CZ2-CD1 3.92Å; W166-L177 HydrophobicContact CZ2-CD2 4.26Å; W166-L177 HydrophobicContact CZ2-CG 4.34Å; W166-L177 HydrophobicContact CZ3-CD1 4.32Å
178	R	84.1	Confident	72.1	Confident	38 Å²	38	58.9 Å²	58.9	14%	0.143	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	156.9	177.4	-66.6	-177.5	-172.9	175.8	9.4	110.8	W31 A164 G165 T169 R176	W31-R178 CarbonylContact O-C 3.6Å; W31-R178 VanDerWaalsContact O-CA 3.29Å; W31-R178 WeakPolarHBondContact O-CA 3.49Å; A164-R178 WeakPolarHBondContact CA-O 3.47Å; A164-R178 VanDerWaalsContact CB-O 3.25Å; A164-R178 WeakPolarHBondContact CB-O 3.15Å; G165-R178 PolarHBondContact N-O 2.75Å; G165-R178 VanDerWaalsContact N-O 3.14Å; G165-R178 PolarHBondContact O-N 2.83Å; T169-R178 PolarHBondContact OG1-NH1 2.69Å; T169-R178 PolarHBondContact OG1-NH2 3.41Å; R176-R178 WeakPolarHBondContact O-CG 3.29Å; R176-R178 PolarHBondContact O-N 3.18Å
179	S	85.2	Confident	71.6	Confident	9 Å²	9	61.2 Å²	61.2	6%	0.063	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	145.8	172.9	-171.7	0	0	0	0	110.8	G30 W31 G163	G30-S179 CarbonylContact C-O 3.57Å; G30-S179 WeakPolarHBondContact CA-O 3.43Å; W31-S179 PolarHBondContact N-O 2.82Å; W31-S179 PolarHBondContact O-N 2.84Å; G163-S179 CarbonylContact O-C 3.52Å; G163-S179 VanDerWaalsContact O-CA 3.25Å; G163-S179 WeakPolarHBondContact O-CA 3.33Å; G163-S179 PolarHBondContact O-OG 2.92Å
180	T	84	Confident	71.3	Confident	10 Å²	10	70.4 Å²	70.4	6%	0.061	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	162.8	170.5	-173.9	0	0	0	0	110.8	S29 F162 G163 N201 M208	S29-T180 WeakPolarHBondContact O-CB 3.12Å; S29-T180 PolarHBondContact O-OG1 3.07Å; F162-T180 WeakPolarHBondContact CA-O 3.25Å; G163-T180 PolarHBondContact N-O 2.77Å; G163-T180 VanDerWaalsContact N-O 3.07Å; G163-T180 PolarHBondContact O-N 3.33Å; T180-N201 PolarHBondContact OG1-OD1 3.34Å; T180-M208 HydrophobicContact CG2-CG 4.48Å
181	V	83.8	Confident	71.3	Confident	17 Å²	17	76 Å²	76	10%	0.103	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	126.1	168.3	-175.1	0	0	0	0	109.3	W31 A160 C161 F162 N201 Y202	W31-V181 HydrophobicContact CH2-CG2 3.49Å; W31-V181 VanDerWaalsContact CH2-CG2 3.49Å; W31-V181 HydrophobicContact CZ3-CG2 3.86Å; A160-V181 HydrophobicContact CB-CG1 3.92Å; C161-V181 CarbonylContact O-C 3.57Å; C161-V181 WeakPolarHBondContact O-CA 3.1Å; F162-V181 HydrophobicContact CD1-CG2 4.3Å; F162-V181 HydrophobicContact CE1-CG2 4.07Å; V181-N201 PolarHBondContact O-OD1 2.72Å; V181-Y202 HydrophobicContact CB-CG 4.34Å; V181-Y202 VanDerWaalsContact O-CB 3.31Å; V181-Y202 WeakPolarHBondContact O-CB 3.07Å; V181-Y202 PolarHBondContact O-N 3.14Å
182	N	82.6	Confident	71.7	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134	177.1	-74.1	-21.2	0	0	0	109	C161 P184 A199 D200 N201 L217 Y248	C161-N182 CarbonylContact C-O 3.58Å; C161-N182 WeakPolarHBondContact CA-O 3.19Å; C161-N182 WeakPolarHBondContact CB-O 2.95Å; C161-N182 PolarHBondContact N-O 3.11Å; C161-N182 PolarHBondContact O-N 2.79Å; N182-P184 WeakPolarHBondContact O-CD 3.47Å; N182-A199 HydrophobicContact CB-CB 3.91Å; N182-D200 CarbonylContact C-O 3.52Å; N182-D200 WeakPolarHBondContact CA-O 3.16Å; N182-N201 PolarHBondContact OD1-OD1 3.26Å; N182-L217 HydrophobicContact CB-CD1 3.56Å; N182-Y248 PolarHBondContact ND2-OH 2.77Å
183	T	82.6	Confident	72.2	Confident	50 Å²	50	74.6 Å²	74.6	31%	0.307	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	115.9	173.4	-64.9	0	0	0	0	108.8	E159 L185 A199 D200	E159-T183 WeakPolarHBondContact O-CG2 3.28Å; E159-T183 PolarHBondContact O-OG1 3.33Å; E159-T183 VanDerWaalsContact O-OG1 3.04Å; T183-L185 HydrophobicContact CG2-CD2 4.48Å; T183-L185 PolarHBondContact O-N 2.94Å; T183-A199 CarbonylContact O-C 3.52Å; T183-A199 VanDerWaalsContact O-CA 3.24Å; T183-A199 WeakPolarHBondContact O-CA 3.23Å; T183-D200 PolarHBondContact N-O 3.35Å; T183-D200 PolarHBondContact O-N 3.17Å
184	P	81.9	Confident	73.3	Confident	24 Å²	24	77.7 Å²	77.7	16%	0.156	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	132.1	174.7	-18.7	30.6	0	0	0	110.7	P157 C161 N182 L217	P157-P184 HydrophobicContact CB-CB 4.44Å; P157-P184 HydrophobicContact CB-CG 4.28Å; C161-P184 HydrophobicContact CB-CG 4.02Å; C161-P184 WeakPolarHBondContact SG-CG 3.34Å; N182-P184 WeakPolarHBondContact O-CD 3.47Å; P184-L217 HydrophobicContact CG-CD2 4.33Å
185	L	76.4	Confident	74.1	Confident	53 Å²	53	75 Å²	75	28%	0.277	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140	175.5	-66.3	179.3	0	0	0	110.4	T183 L187 C198 D200	T183-L185 HydrophobicContact CG2-CD2 4.48Å; T183-L185 PolarHBondContact O-N 2.94Å; L185-L187 PolarHBondContact O-N 2.85Å; L185-C198 HydrophobicContact CB-CB 4.35Å; L185-C198 PolarHBondContact N-O 3.32Å; L185-C198 PolarHBondContact O-N 2.85Å; L185-D200 HydrophobicContact CD1-CB 3.84Å; L185-D200 HydrophobicContact CG-CB 4.37Å
186	P	67	Low	74.4	Confident	113 Å²	113	72.5 Å²	72.5	73%	0.734	33%	0.328	S	S	*	.			trans	-62.9	134.4	168.3	26.3	-31.4	0	0	0	109.7	L188	P186-L188 PolarHBondContact O-N 2.79Å
187	L	63.7	Low	74.4	Confident	12 Å²	12	70.5 Å²	70.5	6%	0.063	32%	0.322	C	S	.	.			trans	-57.5	138.9	177.4	-83.5	172.1	0	0	0	111.7	L185 R192 K193 A196 C198	L185-L187 PolarHBondContact O-N 2.85Å; L187-R192 VanDerWaalsContact CD1-C 3.49Å; L187-R192 HydrophobicContact CD1-CB 3.64Å; L187-R192 WeakPolarHBondContact CD1-O 3.18Å; L187-K193 HydrophobicContact CB-CG 3.94Å; L187-K193 WeakPolarHBondContact O-CE 3.39Å; L187-K193 PolarHBondContact O-NZ 2.83Å; L187-A196 VanDerWaalsContact CD1-C 3.44Å; L187-A196 HydrophobicContact CD1-CB 3.6Å; L187-A196 WeakPolarHBondContact CD1-O 3.49Å; L187-C198 HydrophobicContact CD2-CB 4.35Å; L187-C198 WeakPolarHBondContact CD2-SG 3.41Å
188	L	58.7	Low	74.3	Confident	140 Å²	140	71.5 Å²	71.5	73%	0.733	33%	0.328	S	S	*	.	S	Bend	trans	-67.3	-42.1	170.2	-66.1	172.6	0	0	0	110.5	P186 R190 K193	P186-L188 PolarHBondContact O-N 2.79Å; L188-R190 PolarHBondContact O-N 3.34Å; L188-K193 WeakPolarHBondContact O-CE 3.45Å
189	F	57.5	Low	74.1	Confident	161 Å²	161	69.7 Å²	69.7	71%	0.706	32%	0.322	S	S	*	.	S	Bend	trans	-78.2	109.4	-175.5	-67.9	-76.6	0	0	0	113.7	R191 R192 K193	F189-R191 VanDerWaalsContact C-N 3.29Å; F189-R191 PolarHBondContact O-N 3.21Å; F189-R191 VanDerWaalsContact O-N 3.12Å; F189-R192 PolarHBondContact O-N 3.41Å; F189-K193 WeakPolarHBondContact O-CG 3.29Å; F189-K193 PolarHBondContact O-N 3.25Å
190	R	55.9	Low	73.6	Confident	226 Å²	226	72.3 Å²	72.3	85%	0.853	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-35.6	-173.8	-129.1	179.3	163.4	166.2	-4.4	115.6	L188 K193	L188-R190 PolarHBondContact O-N 3.34Å; R190-K193 HydrophobicContact CG-CD 4.35Å
191	R	58.3	Low	72.9	Confident	235 Å²	235	72.2 Å²	72.2	89%	0.887	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-27.7	-176.6	-78.1	-173.9	166.1	134.2	-1.8	114.2	F189	F189-R191 VanDerWaalsContact C-N 3.29Å; F189-R191 PolarHBondContact O-N 3.21Å; F189-R191 VanDerWaalsContact O-N 3.12Å
192	R	62.6	Low	72	Confident	70 Å²	70	79 Å²	79	26%	0.264	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-12.4	-179.6	-71	-171.4	-179	-174.8	-5	114.4	N123 L187 F189 K194 R195 A196	N123-R192 VanDerWaalsContact O-CZ 3.25Å; N123-R192 PolarHBondContact O-NH1 3.13Å; N123-R192 VanDerWaalsContact O-NH1 3.08Å; N123-R192 PolarHBondContact O-NH2 2.89Å; N123-R192 PolarHBondContact OD1-NH2 3.15Å; L187-R192 VanDerWaalsContact CD1-C 3.49Å; L187-R192 HydrophobicContact CD1-CB 3.64Å; L187-R192 WeakPolarHBondContact CD1-O 3.18Å; F189-R192 PolarHBondContact O-N 3.41Å; R192-K194 PolarHBondContact O-N 2.79Å; R192-R195 PolarHBondContact O-N 2.88Å; R192-A196 PolarHBondContact O-N 3.35Å
193	K	63.3	Low	71	Confident	95 Å²	95	81.6 Å²	81.6	41%	0.413	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.2	-30.5	-176.4	-67.4	-168.4	-172.8	-132.5	0	115	L187 L188 F189 R190	L187-K193 HydrophobicContact CB-CG 3.94Å; L187-K193 WeakPolarHBondContact O-CE 3.39Å; L187-K193 PolarHBondContact O-NZ 2.83Å; L188-K193 WeakPolarHBondContact O-CE 3.45Å; F189-K193 WeakPolarHBondContact O-CG 3.29Å; F189-K193 PolarHBondContact O-N 3.25Å; R190-K193 HydrophobicContact CG-CD 4.35Å
194	K	76.3	Confident	70.2	Confident	163 Å²	163	87.4 Å²	87.4	71%	0.709	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-34.4	-179.9	-65.7	-170.5	177.6	-174.1	0	113.2	R192 T253	R192-K194 PolarHBondContact O-N 2.79Å; K194-T253 WeakPolarHBondContact O-CB 3.38Å; K194-T253 WeakPolarHBondContact O-CG2 3.1Å; K194-T253 PolarHBondContact O-OG1 2.93Å
195	R	81.5	Confident	69.2	Low	44 Å²	44	91.1 Å²	91.1	17%	0.166	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-9.5	-168.4	-72.7	179.5	-68.2	151.6	7.8	114.2	D125 N126 R192 R250 T253 F254 Y317	D125-R195 IonicContact OD1-CZ 3.05Å; D125-R195 IonicContact OD1-NE 2.78Å; D125-R195 IonicContact OD1-NH1 3.99Å; D125-R195 PolarHBondContact OD1-NH1 2.74Å; D125-R195 VanDerWaalsContact OD1-NH1 3.14Å; D125-R195 IonicContact OD1-NH2 3.38Å; D125-R195 PolarHBondContact OD1-NH2 2.84Å; D125-R195 IonicContact OD2-CZ 3.28Å; D125-R195 IonicContact OD2-NH1 3.1Å; D125-R195 PolarHBondContact OD2-NH1 3.01Å; D125-R195 IonicContact OD2-NH2 3.86Å; D125-R195 PolarHBondContact OD2-NH2 2.93Å; N126-R195 VanDerWaalsContact CG-NH1 3.28Å; N126-R195 PolarHBondContact ND2-NH1 3.1Å; N126-R195 WeakPolarHBondContact OD1-CD 3.49Å; N126-R195 PolarHBondContact OD1-NH1 3.36Å; R192-R195 PolarHBondContact O-N 2.88Å; R195-R250 PolarHBondContact O-N 3.36Å; R195-T253 HydrophobicContact CG-CG2 3.83Å; R195-F254 HydrophobicContact CB-CE2 4.04Å; R195-F254 HydrophobicContact CB-CZ 3.95Å; R195-F254 HydrophobicContact CG-CE2 4.2Å; R195-F254 HydrophobicContact CG-CZ 3.9Å; R195-Y317 VanDerWaalsContact NH1-CE1 3.31Å
196	A	84.6	Confident	68.6	Low	3 Å²	3	89.5 Å²	89.5	3%	0.025	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	162.9	179.1	0	0	0	0	0	111.7	L187 R192 H247 Y248	L187-A196 VanDerWaalsContact CD1-C 3.44Å; L187-A196 HydrophobicContact CD1-CB 3.6Å; L187-A196 WeakPolarHBondContact CD1-O 3.49Å; R192-A196 PolarHBondContact O-N 3.35Å; A196-H247 WeakPolarHBondContact CB-NE2 3.38Å; A196-Y248 CarbonylContact C-O 3.52Å; A196-Y248 WeakPolarHBondContact CA-O 3.17Å; A196-Y248 VanDerWaalsContact CB-O 3.3Å; A196-Y248 WeakPolarHBondContact CB-O 3.25Å
197	L	85.2	Confident	68.7	Low	16 Å²	16	84.9 Å²	84.9	8%	0.084	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	149.4	175.8	63	92.6	0	0	0	108.7	L217 F228 Y248 R250	L197-L217 HydrophobicContact CD1-CD2 3.33Å; L197-L217 HydrophobicContact CD2-CD2 4.35Å; L197-F228 WeakPolarHBondContact CD2-O 3.33Å; L197-Y248 VanDerWaalsContact CD1-CB 3.48Å; L197-Y248 HydrophobicContact CD1-CD2 3.68Å; L197-Y248 HydrophobicContact CD1-CG 3.79Å; L197-Y248 PolarHBondContact N-O 2.04Å; L197-Y248 PolarHBondContact O-N 3.37Å; L197-R250 HydrophobicContact CD2-CB 4.14Å; L197-R250 HydrophobicContact CD2-CG 4.35Å
198	C	84.2	Confident	69.2	Low	22 Å²	22	85 Å²	85	15%	0.149	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	156.6	164.1	-80.5	0	0	0	0	108.6	L185 L187 R245 L246	L185-C198 HydrophobicContact CB-CB 4.35Å; L185-C198 PolarHBondContact N-O 3.32Å; L185-C198 PolarHBondContact O-N 2.85Å; L187-C198 HydrophobicContact CD2-CB 4.35Å; L187-C198 WeakPolarHBondContact CD2-SG 3.41Å; C198-R245 HydrophobicContact CB-CB 4.22Å; C198-L246 VanDerWaalsContact CA-O 3.28Å; C198-L246 WeakPolarHBondContact CA-O 3.27Å
199	A	80.3	Confident	70.1	Confident	1 Å²	1	79.4 Å²	79.4	1%	0.008	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	141.1	160.3	0	0	0	0	0	110.3	N182 T183 L217 L246 Y248	N182-A199 HydrophobicContact CB-CB 3.91Å; T183-A199 CarbonylContact O-C 3.52Å; T183-A199 VanDerWaalsContact O-CA 3.24Å; T183-A199 WeakPolarHBondContact O-CA 3.23Å; A199-L217 HydrophobicContact CB-CD2 4.46Å; A199-L246 PolarHBondContact N-O 3.3Å; A199-L246 VanDerWaalsContact N-O 3.09Å; A199-Y248 HydrophobicContact CB-CD2 4.27Å; A199-Y248 HydrophobicContact CB-CE2 3.73Å
200	D	74.7	Confident	71	Confident	63 Å²	63	76.9 Å²	76.9	34%	0.337	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	141.1	162.7	-143.6	-22.6	0	0	0	108.8	N182 T183 L185	N182-D200 CarbonylContact C-O 3.52Å; N182-D200 WeakPolarHBondContact CA-O 3.16Å; T183-D200 PolarHBondContact N-O 3.35Å; T183-D200 PolarHBondContact O-N 3.17Å; L185-D200 HydrophobicContact CD1-CB 3.84Å; L185-D200 HydrophobicContact CG-CB 4.37Å
201	N	71.1	Confident	72.2	Confident	9 Å²	9	66.8 Å²	66.8	5%	0.048	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	132.3	173.1	-167.3	-0.7	0	0	0	108.4	T180 V181 N182 Y203 D206 L207	T180-N201 PolarHBondContact OG1-OD1 3.34Å; V181-N201 PolarHBondContact O-OD1 2.72Å; N182-N201 PolarHBondContact OD1-OD1 3.26Å; N201-Y203 PolarHBondContact ND2-O 2.68Å; N201-Y203 PolarHBondContact O-N 3.49Å; N201-Y203 PolarHBondContact OD1-N 2.75Å; N201-D206 PolarHBondContact ND2-O 3.28Å; N201-L207 HydrophobicContact CB-CD2 3.63Å
202	Y	63.4	Low	73.7	Confident	159 Å²	159	56.2 Å²	56.2	62%	0.624	26%	0.26	S	S	*	.	S	Bend	trans	-57.4	-34.6	175.4	-178.9	-94.4	0	0	0	111.5	V181	V181-Y202 HydrophobicContact CB-CG 4.34Å; V181-Y202 VanDerWaalsContact O-CB 3.31Å; V181-Y202 WeakPolarHBondContact O-CB 3.07Å; V181-Y202 PolarHBondContact O-N 3.14Å
203	Y	63	Low	75.1	Confident	55 Å²	55	54.2 Å²	54.2	22%	0.216	26%	0.257	C	S	.	.	S	Bend	trans	-97.7	124.5	176.5	-57.4	-77.2	0	0	0	111	S29 W31 N201	S29-Y203 WeakPolarHBondContact O-CD2 3.21Å; S29-Y203 VanDerWaalsContact OG-CB 3.27Å; S29-Y203 WeakPolarHBondContact OG-CB 3.09Å; W31-Y203 HydrophobicContact CZ3-CE2 4.14Å; N201-Y203 PolarHBondContact ND2-O 2.68Å; N201-Y203 PolarHBondContact O-N 3.49Å; N201-Y203 PolarHBondContact OD1-N 2.75Å
204	K	64.9	Low	76.6	Confident	172 Å²	172	49.8 Å²	49.8	75%	0.748	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	149.8	177.6	-61.9	-174.1	178.1	-173.5	0	111.7
205	N	61.3	Low	77.5	Confident	101 Å²	101	42 Å²	42	54%	0.54	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	23.6	168.6	-52	-31.9	0	0	0	117.7	K170	K170-N205 PolarHBondContact NZ-O 2.92Å
206	D	64.3	Low	78.2	Confident	19 Å²	19	39.9 Å²	39.9	10%	0.102	20%	0.196	C	C	.	.			trans	-163.3	133.4	162.3	-141	30.7	0	0	0	109.4	V28 S29 K170 N201 C238	V28-D206 HydrophobicContact CB-CB 4.26Å; V28-D206 WeakPolarHBondContact CB-OD2 3.44Å; V28-D206 HydrophobicContact CG1-CB 3.36Å; V28-D206 VanDerWaalsContact CG1-CG 3.5Å; V28-D206 WeakPolarHBondContact CG1-OD2 3.24Å; S29-D206 WeakPolarHBondContact CB-O 3.46Å; S29-D206 WeakPolarHBondContact OG-CB 3.1Å; K170-D206 WeakPolarHBondContact CE-OD1 3.5Å; K170-D206 IonicContact NZ-OD1 3.66Å; N201-D206 PolarHBondContact ND2-O 3.28Å; D206-C238 CarbonylContact C-O 3.5Å; D206-C238 WeakPolarHBondContact CA-O 3.24Å
207	L	68.5	Low	78.7	Confident	17 Å²	17	39.8 Å²	39.8	9%	0.089	20%	0.195	C	C	.	.			trans	-126	165.5	-172.2	-63.9	170	0	0	0	109.5	N201 P235 C238 V241 L246	N201-L207 HydrophobicContact CB-CD2 3.63Å; L207-P235 HydrophobicContact CD1-CG 3.21Å; L207-C238 WeakPolarHBondContact CB-O 3.46Å; L207-C238 PolarHBondContact N-O 2.85Å; L207-V241 HydrophobicContact CD1-CG1 4.16Å; L207-V241 HydrophobicContact CD2-CG1 4.13Å; L207-V241 HydrophobicContact CG-CG1 4.37Å; L207-L246 HydrophobicContact CB-CD2 4.05Å; L207-L246 HydrophobicContact CB-CG 4.41Å; L207-L246 HydrophobicContact CD2-CD1 4.23Å; L207-L246 HydrophobicContact CD2-CG 4.14Å
208	M	73.1	Confident	79.2	Confident	14 Å²	14	39.1 Å²	39.1	7%	0.069	19%	0.191	C	C	.	.			trans	-56.5	141.5	166.7	-61.4	-177.8	77.2	0	0	109	T180 D212 S215 L231 L246 Y248	T180-M208 HydrophobicContact CG2-CG 4.48Å; M208-D212 VanDerWaalsContact CA-OD2 3.3Å; M208-D212 WeakPolarHBondContact CA-OD2 3.3Å; M208-D212 HydrophobicContact CB-CB 4Å; M208-D212 WeakPolarHBondContact CB-OD2 3.17Å; M208-D212 HydrophobicContact CE-CB 3.95Å; M208-S215 WeakPolarHBondContact CE-OG 3.44Å; M208-L231 HydrophobicContact CB-CD2 3.58Å; M208-L231 HydrophobicContact CE-CD2 4.17Å; M208-L231 HydrophobicContact CG-CD2 4.49Å; M208-L231 HydrophobicContact SD-CD2 4.26Å; M208-L246 HydrophobicContact CB-CD1 4.21Å; M208-L246 HydrophobicContact CB-CD2 4.28Å; M208-L246 HydrophobicContact CG-CD1 4.17Å; M208-L246 HydrophobicContact SD-CD1 4.5Å; M208-Y248 PolarHBondContact SD-OH 3.03Å; M208-Y248 VanDerWaalsContact SD-OH 3.35Å
209	C	78.3	Confident	79.6	Confident	23 Å²	23	38 Å²	38	16%	0.155	18%	0.184	C	C	.	.			trans	-134.3	-169.2	-159.9	-160.5	0	0	0	0	112.2	G211 D212 C238	C209-G211 PolarHBondContact O-N 3.39Å; C209-D212 PolarHBondContact N-OD2 3.49Å; C209-D212 VanDerWaalsContact O-CB 3.27Å; C209-D212 WeakPolarHBondContact O-CB 3.47Å; C209-D212 PolarHBondContact O-N 2.9Å; C209-C238 WeakPolarHBondContact CA-SG 3.12Å; C209-C238 HydrophobicContact CB-CB 3.66Å; C209-C238 WeakPolarHBondContact CB-SG 3.32Å; C209-C238 WeakPolarHBondContact SG-CB 3.42Å; C209-C238 CovalentContact SG-SG 2.03Å; C209-C238 PolarHBondContact SG-SG 3.05Å
210	E	77.5	Confident	80.2	Confident	108 Å²	108	41.9 Å²	41.9	51%	0.505	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	129.5	174.8	-65.9	178.6	-166.8	0	0	111.2	G167 K168	G167-E210 CarbonylContact C-O 3.56Å; G167-E210 WeakPolarHBondContact CA-O 3.11Å; K168-E210 HydrophobicContact CD-CB 4.09Å; K168-E210 WeakPolarHBondContact CD-OE2 3.5Å; K168-E210 VanDerWaalsContact CE-OE2 3.22Å; K168-E210 WeakPolarHBondContact CE-OE2 3.33Å; K168-E210 HydrophobicContact CG-CB 4.28Å; K168-E210 PolarHBondContact N-O 3.33Å; K168-E210 IonicContact NZ-OE2 2.64Å; K168-E210 PolarHBondContact NZ-OE2 2.78Å
211	G	80.7	Confident	81	Confident	13 Å²	13	40.3 Å²	40.3	13%	0.134	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	95	-17.1	-173.1	0	0	0	0	0	114.4	L54 C209	L54-G211 WeakPolarHBondContact O-CA 3.26Å; C209-G211 PolarHBondContact O-N 3.39Å
212	D	89.4	Confident	81.9	Confident	14 Å²	14	48.6 Å²	48.6	8%	0.075	23%	0.233	C	C	.	.			trans	-87.7	-7.4	174.7	-68.8	-39.6	0	0	0	113.1	G165 W166 G167 M208 C209 G214 S215 L231	G165-D212 VanDerWaalsContact CA-OD1 3.24Å; G165-D212 WeakPolarHBondContact CA-OD1 3.13Å; W166-D212 PolarHBondContact N-OD1 2.96Å; G167-D212 WeakPolarHBondContact CA-OD1 3.38Å; G167-D212 PolarHBondContact N-OD1 3.32Å; M208-D212 VanDerWaalsContact CA-OD2 3.3Å; M208-D212 WeakPolarHBondContact CA-OD2 3.3Å; M208-D212 HydrophobicContact CB-CB 4Å; M208-D212 WeakPolarHBondContact CB-OD2 3.17Å; M208-D212 HydrophobicContact CE-CB 3.95Å; C209-D212 PolarHBondContact N-OD2 3.49Å; C209-D212 VanDerWaalsContact O-CB 3.27Å; C209-D212 WeakPolarHBondContact O-CB 3.47Å; C209-D212 PolarHBondContact O-N 2.9Å; D212-G214 PolarHBondContact O-N 3.04Å; D212-S215 WeakPolarHBondContact O-CB 3.24Å; D212-S215 PolarHBondContact O-N 2.73Å; D212-S215 PolarHBondContact O-OG 3.38Å; D212-L231 HydrophobicContact CB-CD2 3.65Å; D212-L231 WeakPolarHBondContact O-CD2 3.47Å
213	S	92	Very high	83.1	Confident	28 Å²	28	42.9 Å²	42.9	20%	0.196	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	133.6	178.6	-76.3	0	0	0	0	112.3	C55 A56 H76 S215	C55-S213 WeakPolarHBondContact CB-O 3.12Å; C55-S213 VanDerWaalsContact SG-CB 3.59Å; A56-S213 PolarHBondContact N-O 3.03Å; H76-S213 PolarHBondContact CE1-OG 3.06Å; H76-S213 WeakPolarHBondContact NE2-CB 3.17Å; H76-S213 PolarHBondContact NE2-OG 2.68Å; S213-S215 VanDerWaalsContact C-N 3.25Å; S213-S215 PolarHBondContact O-N 3.06Å
214	G	95.6	Very high	84.6	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.01	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	-4.4	-175	0	0	0	0	0	115.3	A56 D212 L231	A56-G214 CarbonylContact O-C 3.58Å; A56-G214 VanDerWaalsContact O-C 3.3Å; A56-G214 WeakPolarHBondContact O-CA 3.38Å; D212-G214 PolarHBondContact O-N 3.04Å; G214-L231 PolarHBondContact N-O 2.76Å
215	S	94.8	Very high	86	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.184	C	C	.	.			trans	-64.2	154.6	176.7	56.8	0	0	0	0	113.4	A164 M208 D212 S213 I230 L231	A164-S215 WeakPolarHBondContact O-CB 3.49Å; M208-S215 WeakPolarHBondContact CE-OG 3.44Å; D212-S215 WeakPolarHBondContact O-CB 3.24Å; D212-S215 PolarHBondContact O-N 2.73Å; D212-S215 PolarHBondContact O-OG 3.38Å; S213-S215 VanDerWaalsContact C-N 3.25Å; S213-S215 PolarHBondContact O-N 3.06Å; S215-I230 WeakPolarHBondContact O-CA 3.45Å; S215-L231 PolarHBondContact O-N 3.1Å; S215-L231 VanDerWaalsContact OG-CB 3.26Å; S215-L231 WeakPolarHBondContact OG-CB 2.99Å
216	P	96.4	Very high	87.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	139	-179.1	31.3	-36	0	0	0	112.5	M41 S58 G163 F218 L227	M41-P216 VanDerWaalsContact SD-CD 3.53Å; M41-P216 HydrophobicContact SD-CG 3.49Å; M41-P216 WeakPolarHBondContact SD-CG 3.45Å; S58-P216 WeakPolarHBondContact OG-CB 3.44Å; G163-P216 WeakPolarHBondContact CA-O 3.31Å; P216-F218 HydrophobicContact CB-CB 4.48Å; P216-F218 HydrophobicContact CB-CD1 3.89Å; P216-F218 HydrophobicContact CG-CD1 3.8Å; P216-F218 HydrophobicContact CG-CE1 4.2Å; P216-L227 HydrophobicContact CB-CD1 3.25Å
217	L	94.2	Very high	89.3	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	112.1	145.6	-178.1	72.4	0	0	0	107.7	C161 F162 N182 P184 L197 A199 F228 G229 Y248	C161-L217 HydrophobicContact CB-CD1 3.87Å; C161-L217 HydrophobicContact CB-CG 4.17Å; F162-L217 CarbonylContact O-C 3.56Å; F162-L217 WeakPolarHBondContact O-CA 3.46Å; N182-L217 HydrophobicContact CB-CD1 3.56Å; P184-L217 HydrophobicContact CG-CD2 4.33Å; L197-L217 HydrophobicContact CD1-CD2 3.33Å; L197-L217 HydrophobicContact CD2-CD2 4.35Å; A199-L217 HydrophobicContact CB-CD2 4.46Å; L217-F228 PolarHBondContact O-N 3.18Å; L217-G229 PolarHBondContact N-O 2.87Å; L217-G229 PolarHBondContact O-N 3.39Å; L217-Y248 HydrophobicContact CB-CD1 3.62Å; L217-Y248 HydrophobicContact CB-CE1 3.58Å; L217-Y248 HydrophobicContact CB-CG 4.27Å; L217-Y248 HydrophobicContact CD2-CD2 4.44Å; L217-Y248 HydrophobicContact CD2-CG 4.47Å
218	F	95.3	Very high	90.5	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.009	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	141.8	-175.3	60.2	-81.5	0	0	0	112.9	L38 W40 I146 C161 F162 A164 P216 Y225 Y226	L38-F218 HydrophobicContact CD1-CZ 4.28Å; L38-F218 HydrophobicContact CD2-CE2 3.85Å; L38-F218 HydrophobicContact CD2-CZ 3.57Å; W40-F218 AromaticContact CZ2-CD2 3.83Å; W40-F218 HydrophobicContact CZ2-CD2 3.83Å; W40-F218 AromaticContact CZ2-CE2 3.78Å; W40-F218 HydrophobicContact CZ2-CE2 3.78Å; W40-F218 HydrophobicContact CZ2-CG 4.35Å; W40-F218 HydrophobicContact CZ2-CZ 4.27Å; I146-F218 HydrophobicContact CD1-CB 3.39Å; I146-F218 HydrophobicContact CD1-CG 4.17Å; C161-F218 CarbonylContact C-O 3.56Å; C161-F218 WeakPolarHBondContact CA-O 3.35Å; C161-F218 WeakPolarHBondContact CB-O 2.96Å; F162-F218 HydrophobicContact CB-CD1 4.21Å; F162-F218 HydrophobicContact CB-CD2 4.01Å; F162-F218 HydrophobicContact CB-CE1 3.74Å; F162-F218 HydrophobicContact CB-CE2 3.51Å; F162-F218 HydrophobicContact CB-CG 4.34Å; F162-F218 HydrophobicContact CB-CZ 3.37Å; F162-F218 HydrophobicContact CD2-CD2 4.29Å; F162-F218 HydrophobicContact CD2-CE2 4.04Å; F162-F218 HydrophobicContact CG-CE2 4.05Å; F162-F218 HydrophobicContact CG-CZ 4.28Å; F162-F218 PolarHBondContact N-O 3.47Å; F162-F218 WeakPolarHBondContact O-CD1 3.36Å; F162-F218 WeakPolarHBondContact O-CE1 2.93Å; F162-F218 PolarHBondContact O-N 3.41Å; A164-F218 HydrophobicContact CB-CE1 3.86Å; A164-F218 HydrophobicContact CB-CZ 4.35Å; P216-F218 HydrophobicContact CB-CB 4.48Å; P216-F218 HydrophobicContact CB-CD1 3.89Å; P216-F218 HydrophobicContact CG-CD1 3.8Å; P216-F218 HydrophobicContact CG-CE1 4.2Å; F218-Y225 AromaticContact CD2-CD1 3.65Å; F218-Y225 HydrophobicContact CD2-CD1 3.65Å; F218-Y225 HydrophobicContact CD2-CE1 4.3Å; F218-Y225 HydrophobicContact CD2-CG 4.19Å; F218-Y225 HydrophobicContact CE2-CD1 4.13Å; F218-Y225 HydrophobicContact CE2-CE1 4.38Å; F218-Y226 CarbonylContact C-O 3.51Å; F218-Y226 WeakPolarHBondContact CA-O 3.43Å; F218-Y226 WeakPolarHBondContact CB-O 3.46Å
219	C	93.4	Very high	91.5	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	143.7	-175.4	-46	0	0	0	0	110	P158 C161 Y225 Y226 F228	P158-C219 HydrophobicContact CG-CB 3.9Å; C161-C219 HydrophobicContact CB-CB 4.03Å; C161-C219 WeakPolarHBondContact CB-SG 3.33Å; C161-C219 WeakPolarHBondContact SG-CB 3.48Å; C161-C219 CovalentContact SG-SG 2.02Å; C161-C219 PolarHBondContact SG-SG 3.09Å; C219-Y225 WeakPolarHBondContact O-CA 3.34Å; C219-Y226 PolarHBondContact N-O 2.97Å; C219-Y226 PolarHBondContact O-N 3.08Å; C219-F228 HydrophobicContact CB-CD2 3.82Å; C219-F228 HydrophobicContact CB-CE2 3.85Å; C219-F228 HydrophobicContact CB-CG 4.18Å; C219-F228 HydrophobicContact CB-CZ 4.22Å; C219-F228 WeakPolarHBondContact SG-CG 3.47Å
220	E	92.4	Very high	92.3	Very high	82 Å²	82	28.4 Å²	28.4	38%	0.383	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	121.6	174.3	-163.7	173.7	168.4	0	0	110.4	P158 R224 Y225	P158-E220 VanDerWaalsContact CG-O 3.23Å; P158-E220 WeakPolarHBondContact CG-O 3.4Å; E220-R224 CarbonylContact C-O 3.25Å; E220-R224 WeakPolarHBondContact CA-O 3.3Å; E220-Y225 HydrophobicContact CB-CD1 3.91Å; E220-Y225 HydrophobicContact CB-CE1 3.57Å; E220-Y225 HydrophobicContact CG-CD1 4.37Å; E220-Y225 HydrophobicContact CG-CE1 4Å; E220-Y225 PolarHBondContact OE2-OH 2.85Å
221	V	91.8	Very high	93	Very high	29 Å²	29	23.5 Å²	23.5	18%	0.176	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	116.2	174.6	-176.9	0	0	0	0	107.4	P158 G223 R224 Y226 F228	P158-V221 HydrophobicContact CG-CG2 4.14Å; V221-G223 VanDerWaalsContact C-N 3.29Å; V221-G223 PolarHBondContact O-N 3.12Å; V221-R224 PolarHBondContact N-O 3.34Å; V221-R224 PolarHBondContact O-N 2.86Å; V221-R224 VanDerWaalsContact O-N 3.1Å; V221-Y226 HydrophobicContact CB-CD2 3.86Å; V221-Y226 HydrophobicContact CB-CE2 3.83Å; V221-Y226 HydrophobicContact CG2-CD2 4.13Å; V221-F228 HydrophobicContact CG2-CE2 4.17Å; V221-F228 HydrophobicContact CG2-CZ 4.12Å
222	E	89.1	Confident	93.5	Very high	184 Å²	184	23.1 Å²	23.1	86%	0.86	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	43	176.6	-59.2	178	174.7	0	0	113.6
223	G	89.8	Confident	93.3	Very high	39 Å²	39	24.1 Å²	24.1	40%	0.402	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.3	22.7	178.1	0	0	0	0	0	114.7	V221	V221-G223 VanDerWaalsContact C-N 3.29Å; V221-G223 PolarHBondContact O-N 3.12Å
224	R	93	Very high	92.6	Very high	30 Å²	30	24.6 Å²	24.6	11%	0.113	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	142.3	170.3	-64.1	-175.3	-172.4	-108.3	6.6	111.1	N6 C8 G9 R10 E220 V221 Y226	N6-R224 VanDerWaalsContact C-NH1 3.28Å; N6-R224 PolarHBondContact O-NH1 3.03Å; N6-R224 PolarHBondContact O-NH2 3.05Å; N6-R224 PolarHBondContact OD1-NH2 2.78Å; C8-R224 PolarHBondContact O-NH1 3.2Å; G9-R224 WeakPolarHBondContact O-CA 3.5Å; R10-R224 HydrophobicContact CG-CG 3.97Å; E220-R224 CarbonylContact C-O 3.25Å; E220-R224 WeakPolarHBondContact CA-O 3.3Å; V221-R224 PolarHBondContact N-O 3.34Å; V221-R224 PolarHBondContact O-N 2.86Å; V221-R224 VanDerWaalsContact O-N 3.1Å; R224-Y226 HydrophobicContact CB-CD2 4.35Å; R224-Y226 HydrophobicContact CB-CE2 3.71Å; R224-Y226 WeakPolarHBondContact O-CD2 3.42Å
225	Y	95.5	Very high	91.5	Very high	13 Å²	13	25 Å²	25	5%	0.051	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	131.7	172.4	-65.6	-76	0	0	0	111.9	G9 P11 P15 T17 W40 I146 C147 F162 F218 C219 E220	G9-Y225 VanDerWaalsContact CA-O 3.27Å; G9-Y225 WeakPolarHBondContact CA-O 3.49Å; G9-Y225 WeakPolarHBondContact O-CD2 3.21Å; G9-Y225 PolarHBondContact O-N 2.8Å; P11-Y225 HydrophobicContact CG-CD2 4.38Å; P11-Y225 HydrophobicContact CG-CE2 4.3Å; P15-Y225 HydrophobicContact CG-CE2 3.74Å; P15-Y225 VanDerWaalsContact CG-OH 3.32Å; P15-Y225 WeakPolarHBondContact CG-OH 3.4Å; T17-Y225 WeakPolarHBondContact CG2-OH 3.45Å; W40-Y225 AromaticContact CH2-CD2 3.66Å; W40-Y225 HydrophobicContact CH2-CD2 3.66Å; W40-Y225 HydrophobicContact CH2-CE2 4.48Å; W40-Y225 AromaticContact CH2-CG 3.83Å; W40-Y225 HydrophobicContact CH2-CG 3.83Å; W40-Y225 HydrophobicContact CZ2-CG 4.37Å; W40-Y225 HydrophobicContact CZ3-CD2 4.33Å; I146-Y225 WeakPolarHBondContact CG1-O 3.34Å; C147-Y225 WeakPolarHBondContact CB-O 3.41Å; C147-Y225 PolarHBondContact N-O 3.09Å; F162-Y225 HydrophobicContact CD2-CE1 4.29Å; F162-Y225 HydrophobicContact CE2-CE1 4.23Å; F218-Y225 AromaticContact CD2-CD1 3.65Å; F218-Y225 HydrophobicContact CD2-CD1 3.65Å; F218-Y225 HydrophobicContact CD2-CE1 4.3Å; F218-Y225 HydrophobicContact CD2-CG 4.19Å; F218-Y225 HydrophobicContact CE2-CD1 4.13Å; F218-Y225 HydrophobicContact CE2-CE1 4.38Å; C219-Y225 WeakPolarHBondContact O-CA 3.34Å; E220-Y225 HydrophobicContact CB-CD1 3.91Å; E220-Y225 HydrophobicContact CB-CE1 3.57Å; E220-Y225 HydrophobicContact CG-CD1 4.37Å; E220-Y225 HydrophobicContact CG-CE1 4Å; E220-Y225 PolarHBondContact OE2-OH 2.85Å
226	Y	96.5	Very high	90.4	Very high	42 Å²	42	29.8 Å²	29.8	17%	0.165	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	144.1	178.2	-69.1	-95.1	0	0	0	110.8	C147 T153 F218 C219 V221 R224 F228	C147-Y226 HydrophobicContact CB-CD1 3.3Å; C147-Y226 HydrophobicContact CB-CE1 3.45Å; C147-Y226 VanDerWaalsContact CB-CE1 3.45Å; C147-Y226 HydrophobicContact CB-CG 3.91Å; C147-Y226 CarbonylContact O-C 3.55Å; C147-Y226 VanDerWaalsContact O-CA 3.3Å; C147-Y226 WeakPolarHBondContact O-CA 3.34Å; T153-Y226 HydrophobicContact CG2-CD1 4.35Å; T153-Y226 HydrophobicContact CG2-CE1 3.91Å; F218-Y226 CarbonylContact C-O 3.51Å; F218-Y226 WeakPolarHBondContact CA-O 3.43Å; F218-Y226 WeakPolarHBondContact CB-O 3.46Å; C219-Y226 PolarHBondContact N-O 2.97Å; C219-Y226 PolarHBondContact O-N 3.08Å; V221-Y226 HydrophobicContact CB-CD2 3.86Å; V221-Y226 HydrophobicContact CB-CE2 3.83Å; V221-Y226 HydrophobicContact CG2-CD2 4.13Å; R224-Y226 HydrophobicContact CB-CD2 4.35Å; R224-Y226 HydrophobicContact CB-CE2 3.71Å; R224-Y226 WeakPolarHBondContact O-CD2 3.42Å; Y226-F228 PolarHBondContact O-N 2.89Å; Y226-F228 VanDerWaalsContact O-N 3.16Å
227	L	97.1	Very high	89.3	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	84.1	179.8	-178.2	67.2	0	0	0	111.3	V60 V72 I146 C147 P149 P216 G229 I230 V251	V60-L227 HydrophobicContact CG1-CD2 4.44Å; V72-L227 HydrophobicContact CG1-CD2 3.33Å; I146-L227 HydrophobicContact CD1-CB 3.99Å; I146-L227 HydrophobicContact CD1-CD1 4.45Å; I146-L227 HydrophobicContact CG1-CB 4.24Å; I146-L227 HydrophobicContact CG2-CB 3.86Å; I146-L227 HydrophobicContact CG2-CD2 4.38Å; C147-L227 PolarHBondContact O-N 3.04Å; P149-L227 WeakPolarHBondContact CD-O 3.43Å; P149-L227 WeakPolarHBondContact CG-O 3.32Å; P216-L227 HydrophobicContact CB-CD1 3.25Å; L227-G229 VanDerWaalsContact CD1-O 3.32Å; L227-G229 WeakPolarHBondContact CD1-O 3.48Å; L227-I230 HydrophobicContact CD2-CG1 4.38Å; L227-V251 HydrophobicContact CD2-CG1 4.43Å; L227-V251 HydrophobicContact CD2-CG2 4.33Å; L227-V251 HydrophobicContact CG-CG2 4.12Å; L227-V251 VanDerWaalsContact O-CB 3.23Å; L227-V251 WeakPolarHBondContact O-CB 3.32Å; L227-V251 WeakPolarHBondContact O-CG2 3.08Å
228	F	94.8	Very high	88.5	Confident	9 Å²	9	34.2 Å²	34.2	4%	0.039	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	-33.8	-178	-87.7	-125.3	0	0	0	113	P149 T153 P157 L197 L217 C219 V221 Y226 V251	P149-F228 HydrophobicContact CB-CD2 4.38Å; P149-F228 HydrophobicContact CB-CE2 4.48Å; T153-F228 WeakPolarHBondContact O-CZ 3.25Å; P157-F228 HydrophobicContact CB-CD1 4.1Å; P157-F228 HydrophobicContact CB-CE1 3.67Å; L197-F228 WeakPolarHBondContact CD2-O 3.33Å; L217-F228 PolarHBondContact O-N 3.18Å; C219-F228 HydrophobicContact CB-CD2 3.82Å; C219-F228 HydrophobicContact CB-CE2 3.85Å; C219-F228 HydrophobicContact CB-CG 4.18Å; C219-F228 HydrophobicContact CB-CZ 4.22Å; C219-F228 WeakPolarHBondContact SG-CG 3.47Å; V221-F228 HydrophobicContact CG2-CE2 4.17Å; V221-F228 HydrophobicContact CG2-CZ 4.12Å; Y226-F228 PolarHBondContact O-N 2.89Å; Y226-F228 VanDerWaalsContact O-N 3.16Å; F228-V251 PolarHBondContact O-N 3.14Å; F228-V251 VanDerWaalsContact O-N 3.15Å
229	G	94.2	Very high	87.4	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	159.5	-177.3	0	0	0	0	0	114.3	L217 L227 I249	L217-G229 PolarHBondContact N-O 2.87Å; L217-G229 PolarHBondContact O-N 3.39Å; L227-G229 VanDerWaalsContact CD1-O 3.32Å; L227-G229 WeakPolarHBondContact CD1-O 3.48Å; G229-I249 WeakPolarHBondContact CA-O 3.48Å
230	I	95.4	Very high	86	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.6	170.9	-62	158.2	0	0	0	107.2	V72 A74 I128 S215 L227 S232 Y248 I249 V251	V72-I230 HydrophobicContact CG2-CD1 3.47Å; V72-I230 VanDerWaalsContact CG2-CD1 3.47Å; V72-I230 HydrophobicContact CG2-CG1 4.39Å; A74-I230 HydrophobicContact CB-CG2 4.35Å; I128-I230 HydrophobicContact CB-CD1 4.49Å; I128-I230 HydrophobicContact CD1-CD1 3.6Å; I128-I230 HydrophobicContact CG1-CD1 3.73Å; S215-I230 WeakPolarHBondContact O-CA 3.45Å; L227-I230 HydrophobicContact CD2-CG1 4.38Å; I230-S232 PolarHBondContact O-N 3.28Å; I230-Y248 VanDerWaalsContact C-CD1 3.49Å; I230-Y248 CarbonylContact O-C 3.59Å; I230-Y248 WeakPolarHBondContact O-CA 3.45Å; I230-Y248 WeakPolarHBondContact O-CB 3.49Å; I230-I249 HydrophobicContact CB-CB 4.38Å; I230-I249 PolarHBondContact N-O 2.57Å; I230-I249 VanDerWaalsContact N-O 3.13Å; I230-I249 PolarHBondContact O-N 2.79Å; I230-V251 HydrophobicContact CD1-CG2 3.73Å; I230-V251 HydrophobicContact CG1-CG2 3.71Å
231	L	92.1	Very high	84.5	Confident	6 Å²	6	38 Å²	38	3%	0.031	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	122.9	-176.8	-177.3	64.6	0	0	0	109.6	M208 D212 G214 S215 L246 Y248	M208-L231 HydrophobicContact CB-CD2 3.58Å; M208-L231 HydrophobicContact CE-CD2 4.17Å; M208-L231 HydrophobicContact CG-CD2 4.49Å; M208-L231 HydrophobicContact SD-CD2 4.26Å; D212-L231 HydrophobicContact CB-CD2 3.65Å; D212-L231 WeakPolarHBondContact O-CD2 3.47Å; G214-L231 PolarHBondContact N-O 2.76Å; S215-L231 PolarHBondContact O-N 3.1Å; S215-L231 VanDerWaalsContact OG-CB 3.26Å; S215-L231 WeakPolarHBondContact OG-CB 2.99Å; L231-L246 HydrophobicContact CD1-CB 4.26Å; L231-L246 HydrophobicContact CD1-CD2 4Å; L231-Y248 VanDerWaalsContact CA-CD1 3.44Å; L231-Y248 HydrophobicContact CB-CD1 3.97Å; L231-Y248 HydrophobicContact CB-CE1 3.69Å; L231-Y248 HydrophobicContact CD1-CD1 4.23Å; L231-Y248 HydrophobicContact CD1-CE1 3.77Å; L231-Y248 HydrophobicContact CD1-CE2 4.15Å; L231-Y248 HydrophobicContact CG-CE1 4.31Å; L231-Y248 VanDerWaalsContact N-CD1 3.34Å
232	S	90.2	Very high	83	Confident	5 Å²	5	43.8 Å²	43.8	4%	0.035	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	-46.8	-174.3	166.2	0	0	0	0	111.3	H76 D127 I230 H247	H76-S232 PolarHBondContact CE1-O 3.44Å; D127-S232 WeakPolarHBondContact CB-OG 3.29Å; D127-S232 WeakPolarHBondContact OD2-CA 3.37Å; D127-S232 WeakPolarHBondContact OD2-CB 3.46Å; D127-S232 PolarHBondContact OD2-OG 2.92Å; I230-S232 PolarHBondContact O-N 3.28Å; S232-H247 PolarHBondContact N-O 2.53Å
233	A	85	Confident	81.4	Confident	34 Å²	34	42.2 Å²	42.2	28%	0.281	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	157.9	-179.8	0	0	0	0	0	112	H247	A233-H247 HydrophobicContact CB-CB 4.16Å; A233-H247 PolarHBondContact N-O 2.91Å; A233-H247 VanDerWaalsContact N-O 3.17Å; A233-H247 PolarHBondContact O-N 3.38Å
234	G	78.1	Confident	80.1	Confident	39 Å²	39	46.9 Å²	46.9	40%	0.402	27%	0.267	S	S	.	.			trans	-153	175.3	174.1	0	0	0	0	0	110.3
235	P	72.6	Confident	79.2	Confident	9 Å²	9	50.1 Å²	50.1	6%	0.058	28%	0.279	C	S	.	.			trans	-64.5	138.6	173.8	25.8	-31.2	0	0	0	110.9	L207 D237 C238 S240 F244	L207-P235 HydrophobicContact CD1-CG 3.21Å; P235-D237 PolarHBondContact O-N 2.85Å; P235-C238 WeakPolarHBondContact O-CA 3.35Å; P235-C238 PolarHBondContact O-N 3.23Å; P235-S240 WeakPolarHBondContact CB-OG 3.41Å; P235-F244 HydrophobicContact CB-CB 4.1Å
236	A	72	Confident	78.6	Confident	101 Å²	101	49.5 Å²	49.5	84%	0.835	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.7	-177.2	0	0	0	0	0	113.8	C238	A236-C238 VanDerWaalsContact C-N 3.28Å
237	D	73.2	Confident	78.1	Confident	81 Å²	81	48.6 Å²	48.6	43%	0.433	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-2.7	176.9	74.7	-17.2	0	0	0	113.5	P235 K239 S240	P235-D237 PolarHBondContact O-N 2.85Å; D237-K239 WeakPolarHBondContact O-CG 3.01Å; D237-K239 PolarHBondContact O-N 3Å; D237-K239 PolarHBondContact OD1-N 2.86Å; D237-S240 WeakPolarHBondContact OD1-CB 3.42Å; D237-S240 PolarHBondContact OD1-N 3.13Å; D237-S240 PolarHBondContact OD1-OG 3.31Å; D237-S240 WeakPolarHBondContact OD2-CB 2.99Å; D237-S240 PolarHBondContact OD2-N 3.34Å
238	C	76	Confident	77.7	Confident	11 Å²	11	48.5 Å²	48.5	7%	0.074	27%	0.273	C	S	.	.	S	Bend	trans	53.2	22	-175.8	-52.3	0	0	0	0	114	D206 L207 C209 P235 A236	D206-C238 CarbonylContact C-O 3.5Å; D206-C238 WeakPolarHBondContact CA-O 3.24Å; L207-C238 WeakPolarHBondContact CB-O 3.46Å; L207-C238 PolarHBondContact N-O 2.85Å; C209-C238 WeakPolarHBondContact CA-SG 3.12Å; C209-C238 HydrophobicContact CB-CB 3.66Å; C209-C238 WeakPolarHBondContact CB-SG 3.32Å; C209-C238 WeakPolarHBondContact SG-CB 3.42Å; C209-C238 CovalentContact SG-SG 2.03Å; C209-C238 PolarHBondContact SG-SG 3.05Å; P235-C238 WeakPolarHBondContact O-CA 3.35Å; P235-C238 PolarHBondContact O-N 3.23Å; A236-C238 VanDerWaalsContact C-N 3.28Å
239	K	72.4	Confident	77.6	Confident	96 Å²	96	48.1 Å²	48.1	42%	0.417	27%	0.271	S	S	.	.			trans	-134.2	-37.1	-173.9	-68.6	167.9	-168.9	169.2	0	113	D237 V241	D237-K239 WeakPolarHBondContact O-CG 3.01Å; D237-K239 PolarHBondContact O-N 3Å; D237-K239 PolarHBondContact OD1-N 2.86Å; K239-V241 PolarHBondContact O-N 3.27Å
240	S	64.1	Low	77.4	Confident	43 Å²	43	51.5 Å²	51.5	30%	0.301	28%	0.284	S	S	.	.			trans	-69.2	100.3	-171.6	52.2	0	0	0	0	111.6	P235 D237	P235-S240 WeakPolarHBondContact CB-OG 3.41Å; D237-S240 WeakPolarHBondContact OD1-CB 3.42Å; D237-S240 PolarHBondContact OD1-N 3.13Å; D237-S240 PolarHBondContact OD1-OG 3.31Å; D237-S240 WeakPolarHBondContact OD2-CB 2.99Å; D237-S240 PolarHBondContact OD2-N 3.34Å
241	V	61.6	Low	77.4	Confident	26 Å²	26	51.4 Å²	51.4	16%	0.158	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-25.5	178.3	-70.3	0	0	0	0	113.5	L207 K239 L243	L207-V241 HydrophobicContact CD1-CG1 4.16Å; L207-V241 HydrophobicContact CD2-CG1 4.13Å; L207-V241 HydrophobicContact CG-CG1 4.37Å; K239-V241 PolarHBondContact O-N 3.27Å; V241-L243 PolarHBondContact O-N 2.87Å
242	D	60.9	Low	77.4	Confident	150 Å²	150	51.5 Å²	51.5	80%	0.802	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-28.9	-166.3	-69.1	-24.8	0	0	0	113.6
243	L	54.6	Low	77.5	Confident	151 Å²	151	54 Å²	54	79%	0.791	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-34.9	-177.8	-64.9	176.7	0	0	0	113.8	V241	V241-L243 PolarHBondContact O-N 2.87Å
244	F	61.8	Low	77.8	Confident	137 Å²	137	52.7 Å²	52.7	60%	0.601	29%	0.287	S	S	*	.			trans	-130.4	108	-175.4	-72.5	-82.3	0	0	0	111	P235	P235-F244 HydrophobicContact CB-CB 4.1Å
245	R	75.6	Confident	78.6	Confident	98 Å²	98	54.3 Å²	54.3	37%	0.37	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-79.5	163.7	170.7	-67.3	-175.9	175	80.9	1.9	110.4	C198 H247	C198-R245 HydrophobicContact CB-CB 4.22Å; R245-H247 PolarHBondContact O-N 3.07Å
246	L	81.6	Confident	79.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	127.2	168.2	-66.1	176.4	0	0	0	109.7	C198 A199 L207 M208 L231 Y248	C198-L246 VanDerWaalsContact CA-O 3.28Å; C198-L246 WeakPolarHBondContact CA-O 3.27Å; A199-L246 PolarHBondContact N-O 3.3Å; A199-L246 VanDerWaalsContact N-O 3.09Å; L207-L246 HydrophobicContact CB-CD2 4.05Å; L207-L246 HydrophobicContact CB-CG 4.41Å; L207-L246 HydrophobicContact CD2-CD1 4.23Å; L207-L246 HydrophobicContact CD2-CG 4.14Å; M208-L246 HydrophobicContact CB-CD1 4.21Å; M208-L246 HydrophobicContact CB-CD2 4.28Å; M208-L246 HydrophobicContact CG-CD1 4.17Å; M208-L246 HydrophobicContact SD-CD1 4.5Å; L231-L246 HydrophobicContact CD1-CB 4.26Å; L231-L246 HydrophobicContact CD1-CD2 4Å; L246-Y248 HydrophobicContact CB-CD2 4.25Å; L246-Y248 HydrophobicContact CB-CE2 3.48Å; L246-Y248 VanDerWaalsContact CB-CE2 3.48Å; L246-Y248 HydrophobicContact CD1-CE2 4.31Å; L246-Y248 WeakPolarHBondContact CD1-OH 3.29Å
247	H	86.4	Confident	80.6	Confident	22 Å²	22	56.3 Å²	56.3	10%	0.102	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.2	177.5	-177	-106	0	0	0	109.4	A196 S232 A233 R245	A196-H247 WeakPolarHBondContact CB-NE2 3.38Å; S232-H247 PolarHBondContact N-O 2.53Å; A233-H247 HydrophobicContact CB-CB 4.16Å; A233-H247 PolarHBondContact N-O 2.91Å; A233-H247 VanDerWaalsContact N-O 3.17Å; A233-H247 PolarHBondContact O-N 3.38Å; R245-H247 PolarHBondContact O-N 3.07Å
248	Y	89.5	Confident	81.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	147.5	177.2	-62.1	-102.5	0	0	0	110.2	N182 A196 L197 A199 M208 L217 I230 L231 L246	N182-Y248 PolarHBondContact ND2-OH 2.77Å; A196-Y248 CarbonylContact C-O 3.52Å; A196-Y248 WeakPolarHBondContact CA-O 3.17Å; A196-Y248 VanDerWaalsContact CB-O 3.3Å; A196-Y248 WeakPolarHBondContact CB-O 3.25Å; L197-Y248 VanDerWaalsContact CD1-CB 3.48Å; L197-Y248 HydrophobicContact CD1-CD2 3.68Å; L197-Y248 HydrophobicContact CD1-CG 3.79Å; L197-Y248 PolarHBondContact N-O 2.04Å; L197-Y248 PolarHBondContact O-N 3.37Å; A199-Y248 HydrophobicContact CB-CD2 4.27Å; A199-Y248 HydrophobicContact CB-CE2 3.73Å; M208-Y248 PolarHBondContact SD-OH 3.03Å; M208-Y248 VanDerWaalsContact SD-OH 3.35Å; L217-Y248 HydrophobicContact CB-CD1 3.62Å; L217-Y248 HydrophobicContact CB-CE1 3.58Å; L217-Y248 HydrophobicContact CB-CG 4.27Å; L217-Y248 HydrophobicContact CD2-CD2 4.44Å; L217-Y248 HydrophobicContact CD2-CG 4.47Å; I230-Y248 VanDerWaalsContact C-CD1 3.49Å; I230-Y248 CarbonylContact O-C 3.59Å; I230-Y248 WeakPolarHBondContact O-CA 3.45Å; I230-Y248 WeakPolarHBondContact O-CB 3.49Å; L231-Y248 VanDerWaalsContact CA-CD1 3.44Å; L231-Y248 HydrophobicContact CB-CD1 3.97Å; L231-Y248 HydrophobicContact CB-CE1 3.69Å; L231-Y248 HydrophobicContact CD1-CD1 4.23Å; L231-Y248 HydrophobicContact CD1-CE1 3.77Å; L231-Y248 HydrophobicContact CD1-CE2 4.15Å; L231-Y248 HydrophobicContact CG-CE1 4.31Å; L231-Y248 VanDerWaalsContact N-CD1 3.34Å; L246-Y248 HydrophobicContact CB-CD2 4.25Å; L246-Y248 HydrophobicContact CB-CE2 3.48Å; L246-Y248 VanDerWaalsContact CB-CE2 3.48Å; L246-Y248 HydrophobicContact CD1-CE2 4.31Å; L246-Y248 WeakPolarHBondContact CD1-OH 3.29Å
249	I	91.9	Very high	82.6	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	133.1	165.2	-61	-49.7	0	0	0	109.3	D127 I128 G229 I230 V251 F254	D127-I249 HydrophobicContact CB-CD1 3.93Å; D127-I249 HydrophobicContact CB-CG1 3.93Å; D127-I249 VanDerWaalsContact O-CG1 3.32Å; D127-I249 WeakPolarHBondContact O-CG1 3.44Å; I128-I249 HydrophobicContact CB-CG2 4.35Å; G229-I249 WeakPolarHBondContact CA-O 3.48Å; I230-I249 HydrophobicContact CB-CB 4.38Å; I230-I249 PolarHBondContact N-O 2.57Å; I230-I249 VanDerWaalsContact N-O 3.13Å; I230-I249 PolarHBondContact O-N 2.79Å; I249-V251 PolarHBondContact O-N 2.91Å; I249-F254 HydrophobicContact CG2-CD2 3.66Å; I249-F254 HydrophobicContact CG2-CE2 3.31Å; I249-F254 HydrophobicContact CG2-CZ 4.01Å
250	R	91.2	Very high	83.7	Confident	70 Å²	70	57.2 Å²	57.2	26%	0.264	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	101.2	-178	-179.8	169.1	-157.2	-92.8	-3.5	110.3	R195 L197 D252 T253 F254	R195-R250 PolarHBondContact O-N 3.36Å; L197-R250 HydrophobicContact CD2-CB 4.14Å; L197-R250 HydrophobicContact CD2-CG 4.35Å; R250-D252 WeakPolarHBondContact CG-OD1 3.26Å; R250-D252 IonicContact CZ-OD1 2.75Å; R250-D252 IonicContact CZ-OD2 3.45Å; R250-D252 IonicContact NE-OD1 3.14Å; R250-D252 IonicContact NE-OD2 3.64Å; R250-D252 IonicContact NH1-OD1 2.68Å; R250-D252 PolarHBondContact NH1-OD1 3.09Å; R250-D252 IonicContact NH1-OD2 3.73Å; R250-D252 PolarHBondContact NH1-OD2 2.88Å; R250-D252 IonicContact NH2-OD1 3.07Å; R250-D252 IonicContact NH2-OD2 2.77Å; R250-D252 PolarHBondContact NH2-OD2 3.38Å; R250-D252 PolarHBondContact O-N 3.18Å; R250-T253 WeakPolarHBondContact O-CB 3.09Å; R250-T253 PolarHBondContact O-N 3.42Å; R250-F254 VanDerWaalsContact O-CD2 3.29Å; R250-F254 WeakPolarHBondContact O-CD2 3.18Å
251	V	94.7	Very high	85.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-67.3	-34	-163.6	178.7	0	0	0	0	113.8	L148 P149 L227 F228 I230 I249 T253 F254 Y255 I258	L148-V251 HydrophobicContact CD2-CG1 4.09Å; P149-V251 HydrophobicContact CG-CB 3.88Å; P149-V251 HydrophobicContact CG-CG1 3.92Å; L227-V251 HydrophobicContact CD2-CG1 4.43Å; L227-V251 HydrophobicContact CD2-CG2 4.33Å; L227-V251 HydrophobicContact CG-CG2 4.12Å; L227-V251 VanDerWaalsContact O-CB 3.23Å; L227-V251 WeakPolarHBondContact O-CB 3.32Å; L227-V251 WeakPolarHBondContact O-CG2 3.08Å; F228-V251 PolarHBondContact O-N 3.14Å; F228-V251 VanDerWaalsContact O-N 3.15Å; I230-V251 HydrophobicContact CD1-CG2 3.73Å; I230-V251 HydrophobicContact CG1-CG2 3.71Å; I249-V251 PolarHBondContact O-N 2.91Å; V251-T253 PolarHBondContact O-N 2.88Å; V251-T253 VanDerWaalsContact O-N 3.17Å; V251-F254 CarbonylContact O-C 3.48Å; V251-F254 WeakPolarHBondContact O-CA 3.47Å; V251-F254 PolarHBondContact O-N 3.11Å; V251-Y255 PolarHBondContact O-N 3.29Å; V251-I258 HydrophobicContact CG1-CD1 3.79Å
252	D	92.7	Very high	86.8	Confident	7 Å²	7	54 Å²	54	4%	0.037	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-60.3	-29.5	179.1	58.4	-52	0	0	0	112.5	P149 N151 S154 R250 F254 Y255	P149-D252 HydrophobicContact CB-CB 4.27Å; P149-D252 HydrophobicContact CG-CB 4.14Å; N151-D252 PolarHBondContact OD1-OD2 3.44Å; S154-D252 VanDerWaalsContact CB-OD2 3.32Å; S154-D252 WeakPolarHBondContact CB-OD2 3.01Å; R250-D252 WeakPolarHBondContact CG-OD1 3.26Å; R250-D252 IonicContact CZ-OD1 2.75Å; R250-D252 IonicContact CZ-OD2 3.45Å; R250-D252 IonicContact NE-OD1 3.14Å; R250-D252 IonicContact NE-OD2 3.64Å; R250-D252 IonicContact NH1-OD1 2.68Å; R250-D252 PolarHBondContact NH1-OD1 3.09Å; R250-D252 IonicContact NH1-OD2 3.73Å; R250-D252 PolarHBondContact NH1-OD2 2.88Å; R250-D252 IonicContact NH2-OD1 3.07Å; R250-D252 IonicContact NH2-OD2 2.77Å; R250-D252 PolarHBondContact NH2-OD2 3.38Å; R250-D252 PolarHBondContact O-N 3.18Å; D252-F254 VanDerWaalsContact C-N 3.25Å; D252-F254 PolarHBondContact O-N 3.19Å; D252-Y255 WeakPolarHBondContact O-CB 3.34Å; D252-Y255 PolarHBondContact O-N 2.83Å
253	T	90.5	Very high	88.4	Confident	57 Å²	57	51.9 Å²	51.9	35%	0.35	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-69.3	-24.1	175.1	-58.7	0	0	0	0	113	K194 R195 R250 V251	K194-T253 WeakPolarHBondContact O-CB 3.38Å; K194-T253 WeakPolarHBondContact O-CG2 3.1Å; K194-T253 PolarHBondContact O-OG1 2.93Å; R195-T253 HydrophobicContact CG-CG2 3.83Å; R250-T253 WeakPolarHBondContact O-CB 3.09Å; R250-T253 PolarHBondContact O-N 3.42Å; V251-T253 PolarHBondContact O-N 2.88Å; V251-T253 VanDerWaalsContact O-N 3.17Å
254	F	93.1	Very high	90.2	Very high	7 Å²	7	51.3 Å²	51.3	3%	0.031	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-100.9	1.8	179.9	-63.5	-90.1	0	0	0	112.7	Y117 I128 R195 I249 R250 V251 D252 D256 W257 I258	Y117-F254 AromaticContact CD1-CD1 3.94Å; Y117-F254 HydrophobicContact CD1-CD1 3.94Å; Y117-F254 AromaticContact CD1-CE1 3.46Å; Y117-F254 HydrophobicContact CD1-CE1 3.46Å; Y117-F254 VanDerWaalsContact CD1-CE1 3.46Å; Y117-F254 HydrophobicContact CE1-CD1 4.23Å; Y117-F254 AromaticContact CE1-CE1 3.68Å; Y117-F254 HydrophobicContact CE1-CE1 3.68Å; Y117-F254 HydrophobicContact CG-CD1 4.38Å; Y117-F254 HydrophobicContact CG-CE1 4.3Å; I128-F254 HydrophobicContact CD1-CB 4.08Å; I128-F254 HydrophobicContact CD1-CG 4.3Å; I128-F254 HydrophobicContact CG2-CD1 3.95Å; I128-F254 HydrophobicContact CG2-CE1 4.1Å; I128-F254 HydrophobicContact CG2-CG 4.37Å; R195-F254 HydrophobicContact CB-CE2 4.04Å; R195-F254 HydrophobicContact CB-CZ 3.95Å; R195-F254 HydrophobicContact CG-CE2 4.2Å; R195-F254 HydrophobicContact CG-CZ 3.9Å; I249-F254 HydrophobicContact CG2-CD2 3.66Å; I249-F254 HydrophobicContact CG2-CE2 3.31Å; I249-F254 HydrophobicContact CG2-CZ 4.01Å; R250-F254 VanDerWaalsContact O-CD2 3.29Å; R250-F254 WeakPolarHBondContact O-CD2 3.18Å; V251-F254 CarbonylContact O-C 3.48Å; V251-F254 WeakPolarHBondContact O-CA 3.47Å; V251-F254 PolarHBondContact O-N 3.11Å; D252-F254 VanDerWaalsContact C-N 3.25Å; D252-F254 PolarHBondContact O-N 3.19Å; F254-D256 PolarHBondContact O-N 2.75Å; F254-W257 HydrophobicContact CB-CE3 4.35Å; F254-W257 CarbonylContact O-C 3.3Å; F254-W257 WeakPolarHBondContact O-CA 3.46Å; F254-W257 WeakPolarHBondContact O-CB 3.46Å; F254-W257 PolarHBondContact O-N 2.83Å; F254-I258 HydrophobicContact CB-CD1 4.21Å; F254-I258 HydrophobicContact CB-CG1 4.31Å; F254-I258 WeakPolarHBondContact O-CG1 3.18Å; F254-I258 PolarHBondContact O-N 3.35Å
255	Y	94.2	Very high	91.8	Very high	73 Å²	73	45 Å²	45	29%	0.286	20%	0.203	S	C	.	.	H	α-helix	trans	-48.9	-52.5	-175.5	-175.1	-88.4	0	0	0	113.1	L148 P149 T150 V251 D252 W257 I258 M259	L148-Y255 HydrophobicContact CB-CD2 4.08Å; L148-Y255 HydrophobicContact CB-CE2 3.92Å; P149-Y255 WeakPolarHBondContact O-CD2 3.45Å; T150-Y255 HydrophobicContact CG2-CD2 4.26Å; T150-Y255 HydrophobicContact CG2-CE2 3.91Å; V251-Y255 PolarHBondContact O-N 3.29Å; D252-Y255 WeakPolarHBondContact O-CB 3.34Å; D252-Y255 PolarHBondContact O-N 2.83Å; Y255-W257 VanDerWaalsContact C-N 3.31Å; Y255-W257 PolarHBondContact O-N 3.36Å; Y255-I258 WeakPolarHBondContact O-CB 3.31Å; Y255-I258 PolarHBondContact O-N 3.2Å; Y255-I258 VanDerWaalsContact O-N 3.14Å; Y255-M259 HydrophobicContact CD1-CG 4.1Å; Y255-M259 HydrophobicContact CE1-CG 3.71Å; Y255-M259 WeakPolarHBondContact O-CG 2.98Å; Y255-M259 PolarHBondContact O-N 2.87Å
256	D	92.6	Very high	92.6	Very high	112 Å²	112	44.2 Å²	44.2	60%	0.599	20%	0.203	S	C	*	.	H	α-helix	trans	-63.5	-36.4	-179.9	-72.4	-12.7	0	0	0	112.9	F254 K260	F254-D256 PolarHBondContact O-N 2.75Å; D256-K260 WeakPolarHBondContact O-CB 3.44Å; D256-K260 WeakPolarHBondContact O-CD 3.49Å; D256-K260 VanDerWaalsContact O-CG 3.27Å; D256-K260 WeakPolarHBondContact O-CG 3.32Å; D256-K260 PolarHBondContact O-N 3.43Å; D256-K260 VanDerWaalsContact O-N 3.14Å
257	W	94.3	Very high	93.1	Very high	40 Å²	40	50.3 Å²	50.3	15%	0.152	24%	0.24	C	C	.	.	H	α-helix	trans	-67.6	-43.2	174.8	172.1	76.1	0	0	0	110.5	V115 Y117 I128 L130 F254 Y255 M259 K260 S261	V115-W257 HydrophobicContact CG1-CZ2 4.22Å; V115-W257 HydrophobicContact CG2-CZ2 4.33Å; Y117-W257 HydrophobicContact CD2-CB 4.49Å; Y117-W257 AromaticContact CD2-CD1 3.27Å; Y117-W257 AromaticContact CD2-CD2 3.82Å; Y117-W257 HydrophobicContact CD2-CD2 3.82Å; Y117-W257 AromaticContact CD2-CE2 3.65Å; Y117-W257 AromaticContact CD2-CG 3.6Å; Y117-W257 HydrophobicContact CD2-CG 3.6Å; Y117-W257 HydrophobicContact CD2-CZ2 4.47Å; Y117-W257 AromaticContact CD2-NE1 3.31Å; Y117-W257 VanDerWaalsContact CD2-NE1 3.31Å; Y117-W257 HydrophobicContact CE2-CB 4.48Å; Y117-W257 AromaticContact CE2-CD1 3.66Å; Y117-W257 AromaticContact CE2-CG 3.99Å; Y117-W257 HydrophobicContact CE2-CG 3.99Å; Y117-W257 HydrophobicContact CG-CD2 4.11Å; Y117-W257 HydrophobicContact CG-CG 4.29Å; Y117-W257 HydrophobicContact CG-CZ2 4.49Å; I128-W257 HydrophobicContact CB-CZ3 4.46Å; I128-W257 HydrophobicContact CD1-CE3 4.36Å; I128-W257 HydrophobicContact CD1-CZ3 3.85Å; I128-W257 HydrophobicContact CG1-CH2 4.49Å; I128-W257 HydrophobicContact CG1-CZ3 3.85Å; I128-W257 HydrophobicContact CG2-CE3 4.37Å; I128-W257 HydrophobicContact CG2-CH2 4.29Å; I128-W257 HydrophobicContact CG2-CZ3 3.87Å; L130-W257 HydrophobicContact CG-CH2 4.06Å; L130-W257 HydrophobicContact CG-CZ3 4.09Å; F254-W257 HydrophobicContact CB-CE3 4.35Å; F254-W257 CarbonylContact O-C 3.3Å; F254-W257 WeakPolarHBondContact O-CA 3.46Å; F254-W257 WeakPolarHBondContact O-CB 3.46Å; F254-W257 PolarHBondContact O-N 2.83Å; Y255-W257 VanDerWaalsContact C-N 3.31Å; Y255-W257 PolarHBondContact O-N 3.36Å; W257-M259 PolarHBondContact O-N 2.94Å; W257-K260 PolarHBondContact O-N 3.35Å; W257-S261 WeakPolarHBondContact CZ2-OG 3.36Å; W257-S261 PolarHBondContact NE1-OG 2.92Å; W257-S261 WeakPolarHBondContact O-CB 3.18Å; W257-S261 PolarHBondContact O-N 2.98Å; W257-S261 PolarHBondContact O-OG 3.17Å
258	I	96.4	Very high	93.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-58.2	-52.6	178.9	-67.8	167.8	0	0	0	109.6	I128 L130 L148 V251 F254 Y255 K260 S261 I262	I128-I258 HydrophobicContact CD1-CD1 4.04Å; I128-I258 HydrophobicContact CD1-CG1 4.24Å; L130-I258 HydrophobicContact CD1-CB 4.41Å; L130-I258 HydrophobicContact CD1-CG2 3.97Å; L130-I258 HydrophobicContact CD2-CG1 4.47Å; L130-I258 HydrophobicContact CD2-CG2 4.21Å; L148-I258 HydrophobicContact CD1-CG2 3.67Å; L148-I258 HydrophobicContact CD2-CD1 4.07Å; L148-I258 HydrophobicContact CD2-CG2 4.4Å; V251-I258 HydrophobicContact CG1-CD1 3.79Å; F254-I258 HydrophobicContact CB-CD1 4.21Å; F254-I258 HydrophobicContact CB-CG1 4.31Å; F254-I258 WeakPolarHBondContact O-CG1 3.18Å; F254-I258 PolarHBondContact O-N 3.35Å; Y255-I258 WeakPolarHBondContact O-CB 3.31Å; Y255-I258 PolarHBondContact O-N 3.2Å; Y255-I258 VanDerWaalsContact O-N 3.14Å; I258-K260 PolarHBondContact O-N 2.69Å; I258-S261 PolarHBondContact O-N 2.69Å; I258-S261 VanDerWaalsContact O-N 3.12Å; I258-I262 HydrophobicContact CG2-CD1 3.96Å; I258-I262 HydrophobicContact CG2-CG1 4.48Å; I258-I262 WeakPolarHBondContact O-CG1 3.45Å; I258-I262 PolarHBondContact O-N 2.89Å
259	M	95.2	Very high	93.5	Very high	70 Å²	70	55 Å²	55	35%	0.345	28%	0.275	S	S	.	.	H	α-helix	trans	-60.7	-43.1	-179	-63.5	-53.2	-63.9	0	0	112.3	L148 Y255 W257 S261 I262 E263	L148-M259 HydrophobicContact CD1-SD 4.13Å; Y255-M259 HydrophobicContact CD1-CG 4.1Å; Y255-M259 HydrophobicContact CE1-CG 3.71Å; Y255-M259 WeakPolarHBondContact O-CG 2.98Å; Y255-M259 PolarHBondContact O-N 2.87Å; W257-M259 PolarHBondContact O-N 2.94Å; M259-S261 VanDerWaalsContact C-N 3.33Å; M259-S261 PolarHBondContact O-N 2.98Å; M259-I262 PolarHBondContact O-N 3.1Å; M259-I262 HydrophobicContact SD-CD1 4.46Å; M259-E263 PolarHBondContact O-N 3.32Å
260	K	94.8	Very high	93.6	Very high	138 Å²	138	58.7 Å²	58.7	60%	0.6	30%	0.295	S	S	*	.	H	α-helix	trans	-65.9	-36.3	176	-73.7	171.8	-176.5	170.7	0	112.5	D256 W257 I258 E263 K264	D256-K260 WeakPolarHBondContact O-CB 3.44Å; D256-K260 WeakPolarHBondContact O-CD 3.49Å; D256-K260 VanDerWaalsContact O-CG 3.27Å; D256-K260 WeakPolarHBondContact O-CG 3.32Å; D256-K260 PolarHBondContact O-N 3.43Å; D256-K260 VanDerWaalsContact O-N 3.14Å; W257-K260 PolarHBondContact O-N 3.35Å; I258-K260 PolarHBondContact O-N 2.69Å; K260-E263 PolarHBondContact O-N 2.99Å; K260-K264 WeakPolarHBondContact O-CG 3.28Å; K260-K264 PolarHBondContact O-N 3.44Å; K260-K264 VanDerWaalsContact O-N 3.17Å
261	S	95.9	Very high	93.7	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.007	29%	0.294	C	S	.	.	H	α-helix	trans	-70.6	-37.8	179.5	-75.4	0	0	0	0	112	W257 I258 M259 E263 K264 L265	W257-S261 WeakPolarHBondContact CZ2-OG 3.36Å; W257-S261 PolarHBondContact NE1-OG 2.92Å; W257-S261 WeakPolarHBondContact O-CB 3.18Å; W257-S261 PolarHBondContact O-N 2.98Å; W257-S261 PolarHBondContact O-OG 3.17Å; I258-S261 PolarHBondContact O-N 2.69Å; I258-S261 VanDerWaalsContact O-N 3.12Å; M259-S261 VanDerWaalsContact C-N 3.33Å; M259-S261 PolarHBondContact O-N 2.98Å; S261-E263 VanDerWaalsContact C-N 3.33Å; S261-E263 PolarHBondContact O-N 2.98Å; S261-K264 WeakPolarHBondContact O-CB 3.39Å; S261-K264 PolarHBondContact O-N 3.01Å; S261-K264 VanDerWaalsContact O-N 3.15Å; S261-L265 VanDerWaalsContact O-CG 3.32Å; S261-L265 WeakPolarHBondContact O-CG 3.37Å; S261-L265 PolarHBondContact O-N 3.22Å
262	I	95.4	Very high	93.6	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-56.3	-47.6	172	-70.4	171	0	0	0	110.6	N62 I70 L130 I258 M259 K264 L265 K266	N62-I262 HydrophobicContact CB-CG2 3.9Å; I70-I262 HydrophobicContact CG1-CG1 4.21Å; I70-I262 HydrophobicContact CG1-CG2 4.39Å; I70-I262 HydrophobicContact CG2-CD1 4.36Å; I70-I262 HydrophobicContact CG2-CG1 4.16Å; L130-I262 HydrophobicContact CD1-CG1 3.99Å; I258-I262 HydrophobicContact CG2-CD1 3.96Å; I258-I262 HydrophobicContact CG2-CG1 4.48Å; I258-I262 WeakPolarHBondContact O-CG1 3.45Å; I258-I262 PolarHBondContact O-N 2.89Å; M259-I262 PolarHBondContact O-N 3.1Å; M259-I262 HydrophobicContact SD-CD1 4.46Å; I262-K264 VanDerWaalsContact C-N 3.32Å; I262-K264 PolarHBondContact O-N 3.38Å; I262-L265 PolarHBondContact O-N 2.81Å; I262-K266 WeakPolarHBondContact O-CG 3.38Å; I262-K266 PolarHBondContact O-N 3.29Å
263	E	94.4	Very high	93.6	Very high	104 Å²	104	67.5 Å²	67.5	49%	0.486	34%	0.343	S	S	.	.	H	α-helix	trans	-63.8	-35.2	177.4	-64.7	-51	126.1	0	0	113.1	M259 K260 S261 K266	M259-E263 PolarHBondContact O-N 3.32Å; K260-E263 PolarHBondContact O-N 2.99Å; S261-E263 VanDerWaalsContact C-N 3.33Å; S261-E263 PolarHBondContact O-N 2.98Å; E263-K266 WeakPolarHBondContact O-CB 3.43Å; E263-K266 IonicContact OE1-NZ 2.7Å; E263-K266 PolarHBondContact OE1-NZ 3.32Å; E263-K266 IonicContact OE2-NZ 3.41Å; E263-K266 PolarHBondContact OE2-NZ 3.03Å
264	K	92.5	Very high	93.4	Very high	139 Å²	139	68.6 Å²	68.6	60%	0.604	34%	0.341	S	S	*	.	H	α-helix	trans	-66.7	-45.7	174.7	-72.5	175.9	179	-175.4	0	111.8	K260 S261 I262 K266 T267 A268	K260-K264 WeakPolarHBondContact O-CG 3.28Å; K260-K264 PolarHBondContact O-N 3.44Å; K260-K264 VanDerWaalsContact O-N 3.17Å; S261-K264 WeakPolarHBondContact O-CB 3.39Å; S261-K264 PolarHBondContact O-N 3.01Å; S261-K264 VanDerWaalsContact O-N 3.15Å; I262-K264 VanDerWaalsContact C-N 3.32Å; I262-K264 PolarHBondContact O-N 3.38Å; K264-K266 PolarHBondContact O-N 3.06Å; K264-T267 PolarHBondContact O-N 3.33Å; K264-T267 VanDerWaalsContact O-N 3.1Å; K264-T267 PolarHBondContact O-OG1 3.44Å; K264-A268 PolarHBondContact O-N 2.97Å
265	L	95.2	Very high	92.9	Very high	5 Å²	5	72.7 Å²	72.7	3%	0.026	37%	0.367	C	S	.	.	H	α-helix	trans	-61.1	-29.9	-179.9	-69.4	169.2	0	0	0	112.2	I70 N113 V115 L130 R132 S261 I262 T267 A268	I70-L265 HydrophobicContact CD1-CD1 4.26Å; N113-L265 WeakPolarHBondContact OD1-CD2 3.32Å; V115-L265 HydrophobicContact CB-CD2 4.22Å; V115-L265 HydrophobicContact CG1-CD1 3.98Å; V115-L265 HydrophobicContact CG1-CD2 4.01Å; V115-L265 HydrophobicContact CG1-CG 3.98Å; L130-L265 HydrophobicContact CB-CD1 3.85Å; R132-L265 HydrophobicContact CB-CB 4.28Å; R132-L265 HydrophobicContact CB-CD1 4.35Å; R132-L265 WeakPolarHBondContact CD-O 3.28Å; R132-L265 PolarHBondContact NH1-O 2.84Å; S261-L265 VanDerWaalsContact O-CG 3.32Å; S261-L265 WeakPolarHBondContact O-CG 3.37Å; S261-L265 PolarHBondContact O-N 3.22Å; I262-L265 PolarHBondContact O-N 2.81Å; L265-T267 VanDerWaalsContact C-N 3.26Å; L265-T267 PolarHBondContact O-N 3.31Å; L265-A268 PolarHBondContact O-N 2.7Å
266	K	91.9	Very high	92.2	Very high	82 Å²	82	74.9 Å²	74.9	36%	0.357	38%	0.383	S	S	.	.	H	α-helix	trans	-56.9	-38.3	174.6	-73.8	175	-175.8	171	0	113.1	R132 I262 E263 K264	R132-K266 PolarHBondContact NH1-O 3.04Å; I262-K266 WeakPolarHBondContact O-CG 3.38Å; I262-K266 PolarHBondContact O-N 3.29Å; E263-K266 WeakPolarHBondContact O-CB 3.43Å; E263-K266 IonicContact OE1-NZ 2.7Å; E263-K266 PolarHBondContact OE1-NZ 3.32Å; E263-K266 IonicContact OE2-NZ 3.41Å; E263-K266 PolarHBondContact OE2-NZ 3.03Å; K264-K266 PolarHBondContact O-N 3.06Å
267	T	92.3	Very high	91.1	Very high	127 Å²	127	72.6 Å²	72.6	78%	0.779	38%	0.375	S	S	*	.	H	α-helix	trans	-104.6	-4.6	-175.6	58.1	0	0	0	0	113.7	K264 L265	K264-T267 PolarHBondContact O-N 3.33Å; K264-T267 VanDerWaalsContact O-N 3.1Å; K264-T267 PolarHBondContact O-OG1 3.44Å; L265-T267 VanDerWaalsContact C-N 3.26Å; L265-T267 PolarHBondContact O-N 3.31Å
268	A	92.7	Very high	89.8	Confident	30 Å²	30	73.5 Å²	73.5	25%	0.248	38%	0.382	C	S	.	.	S	Bend	trans	-68.3	148.2	178	0	0	0	0	0	111.6	N113 K264 L265	N113-A268 PolarHBondContact ND2-O 3.08Å; K264-A268 PolarHBondContact O-N 2.97Å; L265-A268 PolarHBondContact O-N 2.7Å
269	P	92.1	Very high	87.8	Confident	92 Å²	92	78.7 Å²	78.7	60%	0.597	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-54.4	150.7	175.4	-25	34.7	0	0	0	112.5	N113	N113-P269 PolarHBondContact ND2-O 2.92Å
270	D	93.8	Very high	85.4	Confident	77 Å²	77	79.8 Å²	79.8	41%	0.412	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-74	123	167.6	-157	-26.9	0	0	0	109.6	R112 E272	R112-D270 HydrophobicContact CG-CB 4.27Å; R112-D270 WeakPolarHBondContact CG-OD1 3.48Å; R112-D270 IonicContact CZ-OD2 3.56Å; R112-D270 IonicContact NE-OD2 3.44Å; R112-D270 IonicContact NH1-OD2 3.44Å; R112-D270 PolarHBondContact NH1-OD2 3.21Å; R112-D270 IonicContact NH2-OD2 3.95Å; R112-D270 PolarHBondContact NH2-OD2 3.09Å; D270-E272 WeakPolarHBondContact OD1-CB 3.45Å; D270-E272 PolarHBondContact OD1-N 2.8Å; D270-E272 VanDerWaalsContact OD1-N 3.08Å
271	E	93.4	Very high	82.7	Confident	52 Å²	52	78.4 Å²	78.4	24%	0.243	43%	0.427	C	S	.	.			trans	-125.7	18.4	179.1	-65.8	-167.6	-162	0	0	111.1	P87 R112 N273 R274	P87-E271 HydrophobicContact CG-CB 3.86Å; R112-E271 CarbonylContact O-C 3.54Å; R112-E271 VanDerWaalsContact O-CA 3.32Å; R112-E271 WeakPolarHBondContact O-CA 3.06Å; R112-E271 PolarHBondContact O-N 3.45Å; E271-N273 PolarHBondContact O-N 2.8Å; E271-R274 HydrophobicContact CB-CB 4.03Å; E271-R274 WeakPolarHBondContact O-CB 3.4Å; E271-R274 PolarHBondContact O-N 3.3Å; E271-R274 IonicContact OE1-NH1 3.19Å; E271-R274 PolarHBondContact OE1-NH1 3.48Å; E271-R274 WeakPolarHBondContact OE2-CD 3.27Å; E271-R274 IonicContact OE2-CZ 3.95Å; E271-R274 IonicContact OE2-NE 2.8Å; E271-R274 IonicContact OE2-NH1 3.49Å; E271-R274 PolarHBondContact OE2-NH1 3.35Å
272	E	92.7	Very high	79.6	Confident	62 Å²	62	86.4 Å²	86.4	29%	0.29	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-38.8	179.8	-178.6	176.3	-157.5	0	0	112.5	G88 V111 R112 S134 D270 R274	G88-E272 WeakPolarHBondContact CA-O 3.12Å; G88-E272 PolarHBondContact N-O 3.04Å; V111-E272 WeakPolarHBondContact O-CA 3.3Å; R112-E272 PolarHBondContact O-N 3.31Å; S134-E272 WeakPolarHBondContact CB-OE1 3.48Å; S134-E272 WeakPolarHBondContact CB-OE2 3.02Å; S134-E272 PolarHBondContact OG-OE1 2.78Å; D270-E272 WeakPolarHBondContact OD1-CB 3.45Å; D270-E272 PolarHBondContact OD1-N 2.8Å; D270-E272 VanDerWaalsContact OD1-N 3.08Å; E272-R274 VanDerWaalsContact C-N 3.32Å
273	N	91.4	Very high	76.7	Confident	148 Å²	148	89.9 Å²	89.9	79%	0.791	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	3.3	178.9	-66.3	-51.2	0	0	0	113.5	E271 T275	E271-N273 PolarHBondContact O-N 2.8Å; N273-T275 PolarHBondContact O-N 3.18Å
274	R	86.3	Confident	73.7	Confident	80 Å²	80	90.1 Å²	90.1	30%	0.302	50%	0.497	S	S	.	.			trans	-75.6	125.4	178.7	-173.4	-178.2	178.3	160.8	6.9	108.8	P86 G88 E271 E272 D276	P86-R274 HydrophobicContact CB-CB 4.45Å; P86-R274 HydrophobicContact CB-CG 4.07Å; P86-R274 VanDerWaalsContact CB-O 3.3Å; P86-R274 WeakPolarHBondContact CB-O 3.34Å; G88-R274 WeakPolarHBondContact CA-O 3.18Å; G88-R274 PolarHBondContact N-O 3.25Å; E271-R274 HydrophobicContact CB-CB 4.03Å; E271-R274 WeakPolarHBondContact O-CB 3.4Å; E271-R274 PolarHBondContact O-N 3.3Å; E271-R274 IonicContact OE1-NH1 3.19Å; E271-R274 PolarHBondContact OE1-NH1 3.48Å; E271-R274 WeakPolarHBondContact OE2-CD 3.27Å; E271-R274 IonicContact OE2-CZ 3.95Å; E271-R274 IonicContact OE2-NE 2.8Å; E271-R274 IonicContact OE2-NH1 3.49Å; E271-R274 PolarHBondContact OE2-NH1 3.35Å; E272-R274 VanDerWaalsContact C-N 3.32Å; R274-D276 PolarHBondContact NE-O 2.82Å
275	T	83.5	Confident	70.7	Confident	94 Å²	94	93.1 Å²	93.1	58%	0.577	51%	0.51	S	S	*	.			trans	-122.7	-8.5	175.7	55.4	0	0	0	0	112.7	P86 N273	P86-T275 VanDerWaalsContact CG-C 3.49Å; P86-T275 WeakPolarHBondContact CG-O 3.49Å; N273-T275 PolarHBondContact O-N 3.18Å
276	D	79.9	Confident	67.9	Low	118 Å²	118	98.5 Å²	98.5	63%	0.631	54%	0.538	S	S	*	.	S	Bend	trans	-73.5	135.3	170.5	-64.3	-48.2	0	0	0	110.2	P86 R274	P86-D276 WeakPolarHBondContact CB-O 3.09Å; R274-D276 PolarHBondContact NE-O 2.82Å
277	P	69.8	Low	65.2	Low	65 Å²	65	100.3 Å²	100.3	42%	0.422	56%	0.561	S	S	.	*			trans	-50.2	148.9	177.2	-25.6	32.5	0	0	0	112.3	V279	P277-V279 HydrophobicContact CB-CG2 3.96Å; P277-V279 PolarHBondContact O-N 3.25Å
278	I	66.2	Low	62.4	Low	58 Å²	58	97.2 Å²	97.2	30%	0.297	55%	0.554	S	S	.	*			trans	-74.3	78.8	174	-52.6	-176.3	0	0	0	108.2	Y84 Y114 S280	Y84-I278 PolarHBondContact O-N 2.88Å; Y114-I278 HydrophobicContact CE1-CD1 4.26Å; Y114-I278 HydrophobicContact CE2-CD1 4.48Å; Y114-I278 WeakPolarHBondContact OH-CD1 3.22Å; I278-S280 PolarHBondContact O-N 3.04Å; I278-S280 VanDerWaalsContact O-N 3.13Å
279	V	53.7	Low	59.5	Low	110 Å²	110	103.5 Å²	103.5	67%	0.667	58%	0.58	S	S	*	*			trans	-80	98.5	-178.5	-175.3	0	0	0	0	109.5	P277	P277-V279 HydrophobicContact CB-CG2 3.96Å; P277-V279 PolarHBondContact O-N 3.25Å
280	S	44.4	Very low	56.7	Low	92 Å²	92	109.2 Å²	109.2	64%	0.643	60%	0.595	S	S	*	*			trans	67.9	125.2	150	-56	0	0	0	0	118.8	I278 L282	I278-S280 PolarHBondContact O-N 3.04Å; I278-S280 VanDerWaalsContact O-N 3.13Å; S280-L282 PolarHBondContact O-N 2.91Å
281	L	38.4	Very low	53.8	Low	110 Å²	110	109 Å²	109	58%	0.576	61%	0.611	S	S	*	*			trans	-59	109.1	157.4	-132.1	104.6	0	0	0	108.4	L283 I311	L281-L283 VanDerWaalsContact C-N 3.3Å; L281-L283 HydrophobicContact CD2-CD2 4.01Å; L281-L283 PolarHBondContact O-N 3.14Å; L281-I311 HydrophobicContact CD2-CD1 4.38Å
282	L	31.7	Very low	51	Low	168 Å²	168	113.9 Å²	113.9	88%	0.88	64%	0.638	S	S	*	*			trans	-67.8	94.2	163.4	-79.2	163.7	0	0	0	107.3	S280	S280-L282 PolarHBondContact O-N 2.91Å
283	L	35.3	Very low	48.2	Very low	74 Å²	74	118.2 Å²	118.2	39%	0.387	66%	0.663	S	S	.	*			trans	-61.8	132.1	165.3	-69.1	169.7	0	0	0	107.4	L281 K285 L310	L281-L283 VanDerWaalsContact C-N 3.3Å; L281-L283 HydrophobicContact CD2-CD2 4.01Å; L281-L283 PolarHBondContact O-N 3.14Å; L283-K285 PolarHBondContact O-N 2.79Å; L283-L310 HydrophobicContact CD1-CD2 3.46Å; L283-L310 VanDerWaalsContact CD1-CD2 3.46Å
284	P	30.1	Very low	45.4	Very low	109 Å²	109	116.7 Å²	116.7	71%	0.708	66%	0.661	S	S	*	*			trans	-51	139.4	165.1	-19	28.7	0	0	0	107.9	I286	P284-I286 PolarHBondContact O-N 3.31Å
285	K	30.1	Very low	42.7	Very low	203 Å²	203	121.9 Å²	121.9	88%	0.883	69%	0.688	S	S	*	*			trans	-50.2	107.7	166.4	-82	-178.9	177.8	175.3	0	106.5	L283 S287	L283-K285 PolarHBondContact O-N 2.79Å; K285-S287 PolarHBondContact O-N 2.85Å
286	I	36.1	Very low	40.2	Very low	118 Å²	118	124.4 Å²	124.4	61%	0.605	70%	0.698	S	S	*	*			trans	-67.9	93	171.1	-59.5	174	0	0	0	104.4	P284 G288 M289	P284-I286 PolarHBondContact O-N 3.31Å; I286-G288 VanDerWaalsContact C-N 3.29Å; I286-G288 PolarHBondContact O-N 3.45Å; I286-M289 HydrophobicContact CG2-CB 4.14Å
287	S	35.1	Very low	37.8	Very low	120 Å²	120	128.8 Å²	128.8	84%	0.839	71%	0.711	S	S	*	*			trans	-62.2	98.5	167.7	-88.7	0	0	0	0	107.3	K285	K285-S287 PolarHBondContact O-N 2.85Å
288	G	33.4	Very low	36.1	Very low	61 Å²	61	133.1 Å²	133.1	63%	0.629	73%	0.73	S	S	*	*			trans	55.5	71.9	160.4	0	0	0	0	0	115.6	I286 K290	I286-G288 VanDerWaalsContact C-N 3.29Å; I286-G288 PolarHBondContact O-N 3.45Å; G288-K290 PolarHBondContact O-N 2.99Å
289	M	31.7	Very low	34.6	Very low	163 Å²	163	136 Å²	136	80%	0.803	76%	0.762	S	S	*	*			trans	-70.7	82.1	151.9	-126.8	-178.5	162.6	0	0	107.7	I286 G291	I286-M289 HydrophobicContact CG2-CB 4.14Å; M289-G291 PolarHBondContact O-N 3.06Å; M289-G291 VanDerWaalsContact O-N 3.09Å
290	K	33.3	Very low	33.7	Very low	211 Å²	211	133.5 Å²	133.5	92%	0.917	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	105.4	168.7	-77	-178.9	176.3	178.7	0	107.1	G288	G288-K290 PolarHBondContact O-N 2.99Å
291	G	33.9	Very low	33.2	Very low	72 Å²	72	138.3 Å²	138.3	74%	0.742	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	160.3	-11	167.7	0	0	0	0	0	119.2	M289	M289-G291 PolarHBondContact O-N 3.06Å; M289-G291 VanDerWaalsContact O-N 3.09Å
292	L	34.3	Very low	33.2	Very low	155 Å²	155	138.8 Å²	138.8	81%	0.812	78%	0.778	S	S	*	*	S	Bend	trans	-119.6	95.4	-179.6	-88.9	139.1	0	0	0	112.1
293	L	33.4	Very low	33.9	Very low	154 Å²	154	138.2 Å²	138.2	81%	0.806	78%	0.776	S	S	*	*			trans	81.5	132.3	162.1	-59.5	163	0	0	0	117.4
294	P	32	Very low	34.5	Very low	116 Å²	116	140.2 Å²	140.2	75%	0.753	80%	0.796	S	S	*	*			trans	-72.3	132.2	-173	27.4	-29	0	0	0	110.9	N296	P294-N296 PolarHBondContact O-N 3.38Å
295	H	30.8	Very low	35.6	Very low	189 Å²	189	138.2 Å²	138.2	88%	0.875	78%	0.779	S	S	*	*			trans	-58.4	95.3	172	-97.5	-81	0	0	0	110.6	K297	H295-K297 PolarHBondContact O-N 2.82Å
296	N	31.3	Very low	37	Very low	147 Å²	147	132.2 Å²	132.2	79%	0.786	76%	0.757	S	S	*	*			trans	-71.2	118.4	152	-93.9	-14.7	0	0	0	107.6	P294 L298	P294-N296 PolarHBondContact O-N 3.38Å; N296-L298 VanDerWaalsContact C-N 3.32Å; N296-L298 PolarHBondContact O-N 3.45Å
297	K	28.8	Very low	38	Very low	209 Å²	209	127.2 Å²	127.2	91%	0.909	73%	0.734	S	S	*	*			trans	-59.5	88.4	173.9	-70	177	176.8	177.6	0	109.8	H295	H295-K297 PolarHBondContact O-N 2.82Å
298	L	35	Very low	38.9	Very low	156 Å²	156	124.1 Å²	124.1	82%	0.817	71%	0.707	S	S	*	*			trans	-105	110.1	159.5	-82.5	161.9	0	0	0	107.2	N296 G300	N296-L298 VanDerWaalsContact C-N 3.32Å; N296-L298 PolarHBondContact O-N 3.45Å; L298-G300 PolarHBondContact O-N 2.78Å
299	A	33.5	Very low	40.1	Very low	118 Å²	118	124.2 Å²	124.2	98%	0.975	69%	0.693	S	S	*	*			trans	-65.8	85	169	0	0	0	0	0	108.7
300	G	34.3	Very low	41.5	Very low	58 Å²	58	119.7 Å²	119.7	60%	0.598	67%	0.672	S	S	*	*	S	Bend	trans	-144.6	140.7	172.2	0	0	0	0	0	107.6	L298	L298-G300 PolarHBondContact O-N 2.78Å
301	K	34.3	Very low	42.6	Very low	194 Å²	194	111.5 Å²	111.5	84%	0.843	64%	0.637	S	S	*	*			trans	-43.9	136.9	176.9	-79.9	177.5	175.2	176.5	0	109.5	N303	K301-N303 PolarHBondContact O-N 3.05Å
302	P	39.4	Very low	43.6	Very low	120 Å²	120	108.7 Å²	108.7	78%	0.779	61%	0.607	S	S	*	*			trans	-55.2	116.9	178.9	21.5	-30.6	0	0	0	108.3	S304	P302-S304 PolarHBondContact O-N 2.73Å
303	N	46.9	Very low	44.7	Very low	156 Å²	156	106.9 Å²	106.9	83%	0.834	59%	0.593	S	S	*	*			trans	-62.1	92.9	169.8	-77.4	-11.8	0	0	0	106.6	K301 I305	K301-N303 PolarHBondContact O-N 3.05Å; N303-I305 PolarHBondContact O-N 2.62Å
304	S	47.3	Very low	45.6	Very low	115 Å²	115	107.1 Å²	107.1	80%	0.804	59%	0.589	S	S	*	*			trans	-66.4	103.5	172.8	56.9	0	0	0	0	107.2	P302	P302-S304 PolarHBondContact O-N 2.73Å
305	I	53.4	Low	46.7	Very low	68 Å²	68	108.1 Å²	108.1	35%	0.349	58%	0.579	S	S	.	*			trans	-75	124.2	167.9	-59.8	177.8	0	0	0	105.7	N303 N309 L310	N303-I305 PolarHBondContact O-N 2.62Å; I305-N309 HydrophobicContact CG2-CB 3.35Å; I305-L310 HydrophobicContact CG2-CB 4.24Å
306	N	59.8	Low	47.3	Very low	77 Å²	77	102.4 Å²	102.4	41%	0.412	57%	0.571	S	S	.	*			trans	-59.6	154.9	175.5	76.2	19.6	0	0	0	110	M308 N309 L310	N306-M308 PolarHBondContact O-N 3.14Å; N306-M308 VanDerWaalsContact O-N 3.17Å; N306-M308 PolarHBondContact OD1-N 2.91Å; N306-N309 PolarHBondContact O-N 3.33Å; N306-N309 VanDerWaalsContact O-N 3.1Å; N306-N309 WeakPolarHBondContact OD1-CA 3.43Å; N306-N309 WeakPolarHBondContact OD1-CB 3.09Å; N306-N309 PolarHBondContact OD1-N 2.99Å; N306-N309 PolarHBondContact OD1-ND2 2.96Å; N306-N309 PolarHBondContact OD1-OD1 3.42Å; N306-L310 PolarHBondContact O-N 2.79Å
307	G	56.5	Low	48.2	Very low	12 Å²	12	97.8 Å²	97.8	12%	0.124	54%	0.543	C	S	.	.	H	α-helix	trans	-56.1	-35.9	-175.9	0	0	0	0	0	113.4	L310 I311	G307-L310 PolarHBondContact O-N 2.95Å; G307-I311 WeakPolarHBondContact O-CD1 3.07Å; G307-I311 VanDerWaalsContact O-CG1 3.24Å; G307-I311 WeakPolarHBondContact O-CG1 3.05Å; G307-I311 PolarHBondContact O-N 2.88Å
308	M	52.6	Low	48.5	Very low	56 Å²	56	91.6 Å²	91.6	28%	0.276	52%	0.516	S	S	.	.	H	α-helix	trans	-65.6	-43	177.2	-73.1	-63.5	-88.4	0	0	112.4	Y84 N306 L310 I311 A312	Y84-M308 HydrophobicContact CE2-CE 3.94Å; N306-M308 PolarHBondContact O-N 3.14Å; N306-M308 VanDerWaalsContact O-N 3.17Å; N306-M308 PolarHBondContact OD1-N 2.91Å; M308-L310 VanDerWaalsContact C-N 3.31Å; M308-L310 PolarHBondContact O-N 3.31Å; M308-I311 PolarHBondContact O-N 2.95Å; M308-A312 WeakPolarHBondContact O-CB 3.47Å; M308-A312 PolarHBondContact O-N 3.24Å
309	N	58.6	Low	48.8	Very low	63 Å²	63	89.3 Å²	89.3	34%	0.337	50%	0.501	S	S	.	.	H	α-helix	trans	-68.4	-33	176.8	-71.6	-6.9	0	0	0	110.9	I305 N306 K313 F318	I305-N309 HydrophobicContact CG2-CB 3.35Å; N306-N309 PolarHBondContact O-N 3.33Å; N306-N309 VanDerWaalsContact O-N 3.1Å; N306-N309 WeakPolarHBondContact OD1-CA 3.43Å; N306-N309 WeakPolarHBondContact OD1-CB 3.09Å; N306-N309 PolarHBondContact OD1-N 2.99Å; N306-N309 PolarHBondContact OD1-ND2 2.96Å; N306-N309 PolarHBondContact OD1-OD1 3.42Å; N309-K313 WeakPolarHBondContact O-CB 3.39Å; N309-K313 PolarHBondContact O-N 2.86Å; N309-F318 HydrophobicContact CB-CD2 4.04Å; N309-F318 HydrophobicContact CB-CE2 3.9Å
310	L	62.2	Low	48.7	Very low	68 Å²	68	92.4 Å²	92.4	36%	0.356	49%	0.493	S	S	.	.	H	α-helix	trans	-67.6	-46.5	173.6	-173.6	72.3	0	0	0	111	L283 I305 N306 G307 M308 K313 H314	L283-L310 HydrophobicContact CD1-CD2 3.46Å; L283-L310 VanDerWaalsContact CD1-CD2 3.46Å; I305-L310 HydrophobicContact CG2-CB 4.24Å; N306-L310 PolarHBondContact O-N 2.79Å; G307-L310 PolarHBondContact O-N 2.95Å; M308-L310 VanDerWaalsContact C-N 3.31Å; M308-L310 PolarHBondContact O-N 3.31Å; L310-K313 PolarHBondContact O-N 3.21Å; L310-H314 WeakPolarHBondContact O-CB 3.45Å; L310-H314 PolarHBondContact O-N 3Å
311	I	55.8	Low	48.5	Very low	39 Å²	39	95.5 Å²	95.5	20%	0.2	50%	0.5	C	S	.	.	H	α-helix	trans	-63.4	-46.1	175.8	-65.8	163.5	0	0	0	109.9	F118 L281 G307 M308 K313 H314 Y315	F118-I311 HydrophobicContact CD1-CG2 3.73Å; F118-I311 HydrophobicContact CE1-CG2 3.36Å; F118-I311 HydrophobicContact CZ-CG2 4.11Å; L281-I311 HydrophobicContact CD2-CD1 4.38Å; G307-I311 WeakPolarHBondContact O-CD1 3.07Å; G307-I311 VanDerWaalsContact O-CG1 3.24Å; G307-I311 WeakPolarHBondContact O-CG1 3.05Å; G307-I311 PolarHBondContact O-N 2.88Å; M308-I311 PolarHBondContact O-N 2.95Å; I311-K313 VanDerWaalsContact C-N 3.3Å; I311-K313 PolarHBondContact O-N 3.07Å; I311-H314 WeakPolarHBondContact O-CB 3.05Å; I311-H314 PolarHBondContact O-N 2.64Å; I311-H314 VanDerWaalsContact O-N 3.1Å; I311-Y315 HydrophobicContact CG2-CD2 3.66Å; I311-Y315 HydrophobicContact CG2-CE2 3.68Å; I311-Y315 VanDerWaalsContact O-CD2 3.29Å; I311-Y315 WeakPolarHBondContact O-CD2 3.08Å; I311-Y315 PolarHBondContact O-N 2.03Å
312	A	54.6	Low	48.5	Very low	12 Å²	12	95.8 Å²	95.8	10%	0.099	52%	0.518	C	S	.	.	H	α-helix	trans	-53.9	-49.2	174.8	0	0	0	0	0	110.2	M308 H314 Y315 G316 Y317	M308-A312 WeakPolarHBondContact O-CB 3.47Å; M308-A312 PolarHBondContact O-N 3.24Å; A312-H314 PolarHBondContact O-N 3.17Å; A312-Y315 CarbonylContact O-C 3.58Å; A312-Y315 PolarHBondContact O-N 2.87Å; A312-G316 PolarHBondContact O-N 3.03Å; A312-Y317 WeakPolarHBondContact O-CA 3.38Å; A312-Y317 VanDerWaalsContact O-CB 3.31Å; A312-Y317 WeakPolarHBondContact O-CB 3.32Å; A312-Y317 WeakPolarHBondContact O-CD2 3.48Å; A312-Y317 PolarHBondContact O-N 2.99Å
313	K	57.7	Low	48.9	Very low	118 Å²	118	94.6 Å²	94.6	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-61.4	-42.8	175.7	-172	174.9	-179.4	178.6	0	112.9	N309 L310 I311 Y315 G316 F318	N309-K313 WeakPolarHBondContact O-CB 3.39Å; N309-K313 PolarHBondContact O-N 2.86Å; L310-K313 PolarHBondContact O-N 3.21Å; I311-K313 VanDerWaalsContact C-N 3.3Å; I311-K313 PolarHBondContact O-N 3.07Å; K313-Y315 VanDerWaalsContact C-N 3.27Å; K313-Y315 PolarHBondContact O-N 3.4Å; K313-G316 PolarHBondContact O-N 2.91Å; K313-F318 HydrophobicContact CB-CB 3.79Å; K313-F318 HydrophobicContact CB-CG 4.48Å; K313-F318 HydrophobicContact CG-CB 4.12Å
314	H	53.7	Low	49	Very low	158 Å²	158	91.4 Å²	91.4	73%	0.731	49%	0.487	S	S	*	.	H	α-helix	trans	-60.1	-37.9	178.5	-174.7	69.7	0	0	0	112	L310 I311 A312	L310-H314 WeakPolarHBondContact O-CB 3.45Å; L310-H314 PolarHBondContact O-N 3Å; I311-H314 WeakPolarHBondContact O-CB 3.05Å; I311-H314 PolarHBondContact O-N 2.64Å; I311-H314 VanDerWaalsContact O-N 3.1Å; A312-H314 PolarHBondContact O-N 3.17Å
315	Y	54.1	Low	49.1	Very low	138 Å²	138	90.1 Å²	90.1	54%	0.541	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	6.2	175.3	-69.5	-75.6	0	0	0	114.2	F118 I311 A312 K313 Y317	F118-Y315 HydrophobicContact CZ-CE2 4.25Å; I311-Y315 HydrophobicContact CG2-CD2 3.66Å; I311-Y315 HydrophobicContact CG2-CE2 3.68Å; I311-Y315 VanDerWaalsContact O-CD2 3.29Å; I311-Y315 WeakPolarHBondContact O-CD2 3.08Å; I311-Y315 PolarHBondContact O-N 2.03Å; A312-Y315 CarbonylContact O-C 3.58Å; A312-Y315 PolarHBondContact O-N 2.87Å; K313-Y315 VanDerWaalsContact C-N 3.27Å; K313-Y315 PolarHBondContact O-N 3.4Å; Y315-Y317 VanDerWaalsContact CB-CD2 3.47Å; Y315-Y317 HydrophobicContact CG-CE2 4.09Å
316	G	43.9	Very low	48.9	Very low	68 Å²	68	91.4 Å²	91.4	70%	0.701	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	21.1	173.7	0	0	0	0	0	116.4	A312 K313	A312-G316 PolarHBondContact O-N 3.03Å; K313-G316 PolarHBondContact O-N 2.91Å
317	Y	49	Very low	48.2	Very low	50 Å²	50	92.3 Å²	92.3	20%	0.196	48%	0.481	C	S	.	.			trans	-99	-9.2	-174.9	-56.1	-66.7	0	0	0	115.5	N120 R195 A312 Y315 Q319	N120-Y317 PolarHBondContact ND2-O 3.31Å; R195-Y317 VanDerWaalsContact NH1-CE1 3.31Å; A312-Y317 WeakPolarHBondContact O-CA 3.38Å; A312-Y317 VanDerWaalsContact O-CB 3.31Å; A312-Y317 WeakPolarHBondContact O-CB 3.32Å; A312-Y317 WeakPolarHBondContact O-CD2 3.48Å; A312-Y317 PolarHBondContact O-N 2.99Å; Y315-Y317 VanDerWaalsContact CB-CD2 3.47Å; Y315-Y317 HydrophobicContact CG-CE2 4.09Å; Y317-Q319 PolarHBondContact O-N 2.9Å
318	F	36.3	Very low	47.6	Very low	79 Å²	79	97.6 Å²	97.6	35%	0.346	51%	0.505	S	S	.	.			trans	-79.3	120	-178	-162.7	-93.7	0	0	0	111.2	N309 K313 K320	N309-F318 HydrophobicContact CB-CD2 4.04Å; N309-F318 HydrophobicContact CB-CE2 3.9Å; K313-F318 HydrophobicContact CB-CB 3.79Å; K313-F318 HydrophobicContact CB-CG 4.48Å; K313-F318 HydrophobicContact CG-CB 4.12Å; F318-K320 PolarHBondContact O-N 2.7Å
319	Q	40.9	Very low	47.3	Very low	108 Å²	108	100.6 Å²	100.6	51%	0.505	52%	0.521	S	S	.	.			trans	-71.4	127.6	172.7	-160.7	163.9	-15	0	0	108	Y317 T321	Y317-Q319 PolarHBondContact O-N 2.9Å; Q319-T321 PolarHBondContact O-N 3.05Å
320	K	31	Very low	46.4	Very low	184 Å²	184	103.5 Å²	103.5	80%	0.8	54%	0.535	S	S	*	.			trans	-61.6	105.9	164.7	-101.3	-175.7	173.1	-177.2	0	106.1	F318 V322	F318-K320 PolarHBondContact O-N 2.7Å; K320-V322 PolarHBondContact O-N 3.41Å; K320-V322 VanDerWaalsContact O-N 3.14Å
321	T	30.9	Very low	45.1	Very low	122 Å²	122	106.4 Å²	106.4	75%	0.748	55%	0.55	S	S	*	.			trans	-56.7	113.4	152.1	39.3	0	0	0	0	106.2	Q319	Q319-T321 PolarHBondContact O-N 3.05Å
322	V	33.3	Very low	44.1	Very low	201 Å²	201	112.5 Å²	112.5	100%	1.218	58%	0.582	S	S	*	*			trans	-86.5	0	164.5	178.5	0	0	0	0	106.8	K320	K320-V322 PolarHBondContact O-N 3.41Å; K320-V322 VanDerWaalsContact O-N 3.14Å

Retrieved 322 of 322 residues in 214.3 ms (Link to these results)

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