A0A5K4EN39_SCHMA Loading...

Growth arrest-specific 2-related

AlphaFold DB , UniProt , Accession A0A5K4EN39, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 779 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	33.1	Very low	236 Å²	236	149.2 Å²	149.2	100%	1.163	83%	0.826	S	S	*	*				0	152.9	0	-75.6	172.2	157.6	0	0	108.5
2	I	33.4	Very low	33.2	Very low	158 Å²	158	152.7 Å²	152.7	81%	0.81	83%	0.831	S	S	*	*			trans	63.1	96.1	169	-56.5	169	0	0	0	113.7
3	K	33	Very low	33	Very low	185 Å²	185	147.8 Å²	147.8	80%	0.804	82%	0.815	S	S	*	*				58	91.5	101	-73.4	-172.4	175.4	-177.1	0	114.2
4	T	32.4	Very low	32.8	Very low	132 Å²	132	146 Å²	146	81%	0.81	81%	0.81	S	S	*	*				72.5	98.8	83.8	60.4	0	0	0	0	116
5	A	33.8	Very low	32.7	Very low	83 Å²	83	145.7 Å²	145.7	69%	0.686	81%	0.806	S	S	*	*			trans	-167	157.6	140	0	0	0	0	0	112.2
6	H	34.4	Very low	32.5	Very low	183 Å²	183	149.3 Å²	149.3	85%	0.847	82%	0.815	S	S	*	*			trans	72.1	120.3	163.2	-56.7	-67.1	0	0	0	122.6
7	S	32.3	Very low	32.6	Very low	109 Å²	109	149 Å²	149	76%	0.762	81%	0.811	S	S	*	*			trans	67	98.5	132	-172.1	0	0	0	0	121.2
8	V	36	Very low	32.6	Very low	149 Å²	149	146.4 Å²	146.4	90%	0.903	81%	0.806	S	S	*	*			trans	-136	134	132.9	-167.9	0	0	0	0	109
9	S	31.1	Very low	32.6	Very low	88 Å²	88	146.1 Å²	146.1	62%	0.615	81%	0.811	S	S	*	*			trans	-116.2	157.5	172.1	56.3	0	0	0	0	110.9
10	N	31.3	Very low	32.5	Very low	150 Å²	150	143 Å²	143	80%	0.802	80%	0.799	S	S	*	*			trans	90.7	161	179.8	-52.1	-47.6	0	0	0	116.2
11	L	31.8	Very low	32.6	Very low	168 Å²	168	142.2 Å²	142.2	88%	0.88	80%	0.798	S	S	*	*			trans	74	73.2	177.1	-56	173.9	0	0	0	117.3
12	H	34.2	Very low	32.8	Very low	191 Å²	191	136.8 Å²	136.8	88%	0.884	77%	0.772	S	S	*	*				-146.8	134.2	114.2	-138.3	-75.6	0	0	0	112.2
13	S	30.4	Very low	32.9	Very low	90 Å²	90	135 Å²	135	63%	0.629	76%	0.758	S	S	*	*			trans	-102.4	172.3	176.6	50.7	0	0	0	0	111.5
14	T	30.2	Very low	32.7	Very low	122 Å²	122	136.8 Å²	136.8	75%	0.748	76%	0.76	S	S	*	*			trans	81.9	147.4	167.4	-25.3	0	0	0	0	116
15	L	31.9	Very low	32.8	Very low	141 Å²	141	134.7 Å²	134.7	74%	0.738	75%	0.748	S	S	*	*			trans	80.4	53.6	170.1	-49.8	179.7	0	0	0	118.9	L17	L15-L17 HydrophobicContact CD2-CD1 4.28Å
16	E	28.7	Very low	32.8	Very low	204 Å²	204	139.5 Å²	139.5	95%	0.953	76%	0.756	S	S	*	*			trans	-90.6	109.5	142	-71.5	-148.7	137.1	0	0	109.3
17	L	34.8	Very low	32.8	Very low	144 Å²	144	136.5 Å²	136.5	75%	0.754	76%	0.755	S	S	*	*			trans	-123.2	123.3	175.1	-86.9	165.7	0	0	0	108.9	L15	L15-L17 HydrophobicContact CD2-CD1 4.28Å
18	S	32.3	Very low	33.1	Very low	103 Å²	103	135.6 Å²	135.6	72%	0.72	75%	0.749	S	S	*	*			trans	-57.4	142	179.9	-53.1	0	0	0	0	112	C20	S18-C20 VanDerWaalsContact C-N 3.34Å; S18-C20 PolarHBondContact O-N 3.46Å
19	P	32.4	Very low	33.9	Very low	139 Å²	139	133.8 Å²	133.8	90%	0.903	73%	0.731	S	S	*	*	S	Bend	trans	-77.9	74.9	-169	32	-37.2	0	0	0	113
20	C	30.3	Very low	35	Very low	84 Å²	84	136.6 Å²	136.6	57%	0.568	73%	0.732	S	S	*	*			trans	-139.7	48.4	174.3	-162.8	0	0	0	0	112.9	S18	S18-C20 VanDerWaalsContact C-N 3.34Å; S18-C20 PolarHBondContact O-N 3.46Å
21	V	34.5	Very low	36.5	Very low	128 Å²	128	133.9 Å²	133.9	78%	0.776	72%	0.721	S	S	*	*			trans	-117.1	81.2	177.9	-172.9	0	0	0	0	110.7	K23	V21-K23 PolarHBondContact O-N 3.48Å
22	I	38.6	Very low	38.5	Very low	122 Å²	122	128.1 Å²	128.1	63%	0.626	69%	0.689	S	S	*	*			trans	-71.3	124.1	172.2	-61.6	176.4	0	0	0	109	R24 F180	I22-R24 PolarHBondContact O-N 3.05Å; I22-F180 HydrophobicContact CD1-CD2 4.21Å; I22-F180 HydrophobicContact CD1-CE2 4.23Å
23	K	35.8	Very low	40.8	Very low	119 Å²	119	125.3 Å²	125.3	52%	0.517	68%	0.679	S	S	.	*			trans	-66.9	120.9	177.7	-66.9	173.7	-169.2	154.9	0	110.5	V21 T25 N177	V21-K23 PolarHBondContact O-N 3.48Å; K23-T25 PolarHBondContact O-N 3.16Å; K23-N177 VanDerWaalsContact CE-OD1 3.29Å; K23-N177 WeakPolarHBondContact CE-OD1 3.31Å; K23-N177 PolarHBondContact NZ-OD1 2.79Å
24	R	30.4	Very low	43.7	Very low	223 Å²	223	122 Å²	122	84%	0.842	66%	0.655	S	S	*	*			trans	-67	102.2	-179.2	-69.4	177	175.6	140	-1.3	111.4	I22	I22-R24 PolarHBondContact O-N 3.05Å
25	T	33.8	Very low	46.6	Very low	89 Å²	89	118.3 Å²	118.3	55%	0.546	63%	0.63	S	S	.	*			trans	-130.5	106	169.5	48.8	0	0	0	0	110.9	K23 K182	K23-T25 PolarHBondContact O-N 3.16Å; T25-K182 PolarHBondContact O-NZ 3.12Å; T25-K182 PolarHBondContact OG1-NZ 3.17Å
26	Q	32.8	Very low	49.5	Very low	183 Å²	183	116.5 Å²	116.5	86%	0.855	62%	0.618	S	S	*	*	S	Bend	trans	59.5	131.3	173.4	-60.5	-179.6	-0.4	0	0	116.6
27	S	35.5	Very low	52.6	Low	120 Å²	120	106.8 Å²	106.8	84%	0.839	57%	0.573	S	S	*	*	S	Bend	trans	43.4	81.7	-169	55.7	0	0	0	0	114.3	H29	S27-H29 VanDerWaalsContact C-N 3.3Å; S27-H29 PolarHBondContact O-N 3.08Å
28	S	37.4	Very low	55.5	Low	91 Å²	91	100.7 Å²	100.7	64%	0.636	54%	0.54	S	S	*	.			trans	-65.3	86.8	169.8	-64.9	0	0	0	0	111	F30	S28-F30 PolarHBondContact O-N 2.81Å
29	H	53.3	Low	58.5	Low	111 Å²	111	97.1 Å²	97.1	51%	0.514	52%	0.515	S	S	.	.			trans	-61.5	127.2	163.8	-156.1	-68.4	0	0	0	108.5	S27 V31 N226	S27-H29 VanDerWaalsContact C-N 3.3Å; S27-H29 PolarHBondContact O-N 3.08Å; H29-V31 PolarHBondContact O-N 3.41Å; H29-N226 PolarHBondContact CE1-O 3.34Å
30	F	53.9	Low	61.5	Low	147 Å²	147	90.5 Å²	90.5	65%	0.645	47%	0.472	S	S	*	.			trans	-65.3	124.5	170.1	-178.1	-97.1	0	0	0	107.8	S28 Q32	S28-F30 PolarHBondContact O-N 2.81Å; F30-Q32 HydrophobicContact CE1-CB 4.36Å
31	V	63.8	Low	64.6	Low	92 Å²	92	86.8 Å²	86.8	56%	0.558	45%	0.447	S	S	*	.			trans	-118.8	124.6	172.4	179.7	0	0	0	0	105.8	H29 I33	H29-V31 PolarHBondContact O-N 3.41Å; V31-I33 PolarHBondContact O-N 3.38Å
32	Q	74.5	Confident	67.6	Low	47 Å²	47	82.6 Å²	82.6	22%	0.22	42%	0.417	C	S	.	.			trans	-70.1	114.3	178.9	-176.6	175.2	49.4	0	0	108.9	F30 L34 T228 E230 K231	F30-Q32 HydrophobicContact CE1-CB 4.36Å; Q32-L34 PolarHBondContact O-N 3.23Å; Q32-T228 WeakPolarHBondContact CB-O 3.45Å; Q32-E230 VanDerWaalsContact OE1-N 3.1Å; Q32-K231 VanDerWaalsContact OE1-CB 3.3Å
33	I	82.3	Confident	70.3	Confident	132 Å²	132	80.1 Å²	80.1	68%	0.677	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-72	116.3	171.2	-59	177.7	0	0	0	107.1	V31	V31-I33 PolarHBondContact O-N 3.38Å
34	L	90	Very high	73.2	Confident	22 Å²	22	74.7 Å²	74.7	12%	0.115	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-70.3	144.3	170.6	-69.1	-167.5	0	0	0	110.5	Q32 M38 E230 K231 L234	Q32-L34 PolarHBondContact O-N 3.23Å; L34-M38 HydrophobicContact CB-CB 4.02Å; L34-M38 HydrophobicContact CD1-CB 4.03Å; L34-M38 HydrophobicContact CD2-CB 3.89Å; L34-M38 HydrophobicContact CG-CB 4.2Å; L34-E230 HydrophobicContact CD1-CG 3.97Å; L34-E230 HydrophobicContact CD2-CB 4.13Å; L34-E230 HydrophobicContact CD2-CG 4.04Å; L34-E230 HydrophobicContact CG-CG 4.17Å; L34-K231 HydrophobicContact CD2-CB 4.14Å; L34-L234 HydrophobicContact CD1-CD1 3.82Å; L34-L234 HydrophobicContact CD2-CD1 4.49Å
35	D	91.3	Very high	76.4	Confident	43 Å²	43	64.1 Å²	64.1	23%	0.23	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-73.4	160.4	161	70.9	67.2	0	0	0	110.6	S37 M38 C39	D35-S37 PolarHBondContact O-N 3.44Å; D35-S37 VanDerWaalsContact O-N 3.11Å; D35-S37 WeakPolarHBondContact OD1-CA 3.17Å; D35-S37 WeakPolarHBondContact OD1-CB 3.43Å; D35-S37 PolarHBondContact OD1-N 2.93Å; D35-S37 PolarHBondContact OD1-OG 3.12Å; D35-M38 PolarHBondContact O-N 3.11Å; D35-M38 PolarHBondContact OD1-N 3.17Å; D35-M38 VanDerWaalsContact OD1-N 3.1Å; D35-C39 PolarHBondContact O-N 3.49Å
36	E	93	Very high	79.3	Confident	104 Å²	104	60 Å²	60	49%	0.486	32%	0.315	S	S	.	.	H	α-helix	trans	-54.2	-33.4	-177.7	-175.1	70.6	173.8	0	0	112.8	C39 V40 H534 T545	E36-C39 WeakPolarHBondContact O-CB 3.32Å; E36-C39 PolarHBondContact O-N 3.16Å; E36-V40 WeakPolarHBondContact O-CG2 3.35Å; E36-V40 PolarHBondContact O-N 3.45Å; E36-H534 IonicContact OE1-CE1 3.68Å; E36-H534 PolarHBondContact OE1-CE1 3.03Å; E36-H534 IonicContact OE1-ND1 3.61Å; E36-T545 HydrophobicContact CB-CG2 4.41Å; E36-T545 HydrophobicContact CG-CG2 3.85Å
37	S	94.6	Very high	82.1	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-69.4	-38.7	178.8	-35.2	0	0	0	0	111.2	D35 V40 V41 L544 T545	D35-S37 PolarHBondContact O-N 3.44Å; D35-S37 VanDerWaalsContact O-N 3.11Å; D35-S37 WeakPolarHBondContact OD1-CA 3.17Å; D35-S37 WeakPolarHBondContact OD1-CB 3.43Å; D35-S37 PolarHBondContact OD1-N 2.93Å; D35-S37 PolarHBondContact OD1-OG 3.12Å; S37-V40 PolarHBondContact O-N 3.03Å; S37-V41 WeakPolarHBondContact O-CG2 3.43Å; S37-V41 PolarHBondContact O-N 2.77Å; S37-L544 WeakPolarHBondContact OG-CA 3.23Å; S37-T545 PolarHBondContact OG-N 3.07Å
38	M	94.8	Very high	85	Confident	15 Å²	15	51.8 Å²	51.8	7%	0.074	26%	0.262	C	S	.	.	H	α-helix	trans	-72.5	-31.2	175	-60.5	-64	94	0	0	111.9	L34 D35 V41 R42 K231 L234	L34-M38 HydrophobicContact CB-CB 4.02Å; L34-M38 HydrophobicContact CD1-CB 4.03Å; L34-M38 HydrophobicContact CD2-CB 3.89Å; L34-M38 HydrophobicContact CG-CB 4.2Å; D35-M38 PolarHBondContact O-N 3.11Å; D35-M38 PolarHBondContact OD1-N 3.17Å; D35-M38 VanDerWaalsContact OD1-N 3.1Å; M38-V41 HydrophobicContact CE-CG2 3.95Å; M38-V41 PolarHBondContact O-N 3.16Å; M38-R42 WeakPolarHBondContact O-CB 3.23Å; M38-R42 PolarHBondContact O-N 2.97Å; M38-K231 HydrophobicContact CG-CG 4.35Å; M38-K231 HydrophobicContact SD-CG 4.05Å; M38-L234 HydrophobicContact CB-CD1 4.48Å
39	C	95	Very high	87.7	Confident	28 Å²	28	47.5 Å²	47.5	19%	0.189	23%	0.232	C	C	.	.	H	α-helix	trans	-60.1	-45.9	168.7	-74.3	0	0	0	0	111.8	D35 E36 R42 E43	D35-C39 PolarHBondContact O-N 3.49Å; E36-C39 WeakPolarHBondContact O-CB 3.32Å; E36-C39 PolarHBondContact O-N 3.16Å; C39-R42 WeakPolarHBondContact O-CB 3.18Å; C39-R42 PolarHBondContact O-N 3.14Å; C39-E43 PolarHBondContact O-N 3.36Å; C39-E43 VanDerWaalsContact O-N 3.08Å
40	V	95.7	Very high	89.5	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-64.3	-39.7	176.3	173.8	0	0	0	0	112.1	E36 S37 R42 E43 D44 F531 M536 T545	E36-V40 WeakPolarHBondContact O-CG2 3.35Å; E36-V40 PolarHBondContact O-N 3.45Å; S37-V40 PolarHBondContact O-N 3.03Å; V40-R42 VanDerWaalsContact C-N 3.33Å; V40-R42 PolarHBondContact O-N 3.03Å; V40-E43 PolarHBondContact O-N 3.14Å; V40-D44 PolarHBondContact O-N 3.4Å; V40-D44 VanDerWaalsContact O-N 3.09Å; V40-F531 HydrophobicContact CG1-CD1 3.44Å; V40-F531 VanDerWaalsContact CG1-CD1 3.44Å; V40-F531 HydrophobicContact CG1-CE1 3.66Å; V40-M536 HydrophobicContact CB-CE 4.23Å; V40-M536 HydrophobicContact CG1-CE 3.84Å; V40-M536 HydrophobicContact CG1-SD 3.9Å; V40-T545 HydrophobicContact CG2-CG2 4.31Å
41	V	96	Very high	91.1	Very high	6 Å²	6	41.6 Å²	41.6	4%	0.036	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-40.6	172.3	171.2	0	0	0	0	111.4	S37 M38 D44 L45 L234 M238 L255	S37-V41 WeakPolarHBondContact O-CG2 3.43Å; S37-V41 PolarHBondContact O-N 2.77Å; M38-V41 HydrophobicContact CE-CG2 3.95Å; M38-V41 PolarHBondContact O-N 3.16Å; V41-D44 PolarHBondContact O-N 2.84Å; V41-L45 HydrophobicContact CG1-CD1 3.95Å; V41-L45 HydrophobicContact CG1-CG 4.37Å; V41-L45 WeakPolarHBondContact O-CB 3.47Å; V41-L45 WeakPolarHBondContact O-CG 3.46Å; V41-L45 PolarHBondContact O-N 3.19Å; V41-L234 HydrophobicContact CG1-CB 4.1Å; V41-M238 HydrophobicContact CG1-CG 3.96Å; V41-M238 HydrophobicContact CG1-SD 4.3Å; V41-L255 HydrophobicContact CB-CD1 4.13Å; V41-L255 HydrophobicContact CG2-CD1 3.53Å
42	R	96.6	Very high	92.5	Very high	40 Å²	40	37.8 Å²	37.8	15%	0.151	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-40.7	177.1	-175.3	179.5	65.4	-165.5	-6.1	112.7	M38 C39 V40 T46 A64 L67 E230 L234	M38-R42 WeakPolarHBondContact O-CB 3.23Å; M38-R42 PolarHBondContact O-N 2.97Å; C39-R42 WeakPolarHBondContact O-CB 3.18Å; C39-R42 PolarHBondContact O-N 3.14Å; V40-R42 VanDerWaalsContact C-N 3.33Å; V40-R42 PolarHBondContact O-N 3.03Å; R42-T46 WeakPolarHBondContact O-CB 3.39Å; R42-T46 PolarHBondContact O-N 3.27Å; R42-T46 PolarHBondContact O-OG1 3.32Å; R42-A64 VanDerWaalsContact CD-O 3.27Å; R42-A64 WeakPolarHBondContact CD-O 3.27Å; R42-A64 HydrophobicContact CG-CB 4.2Å; R42-A64 WeakPolarHBondContact CG-O 3.4Å; R42-L67 HydrophobicContact CG-CB 4.47Å; R42-L67 HydrophobicContact CG-CD2 4.01Å; R42-E230 WeakPolarHBondContact CD-OE1 3.39Å; R42-E230 IonicContact CZ-OE1 3.17Å; R42-E230 IonicContact NE-OE1 3.64Å; R42-E230 IonicContact NH1-OE1 2.82Å; R42-E230 PolarHBondContact NH1-OE1 3.45Å; R42-L234 HydrophobicContact CB-CD1 3.89Å; R42-L234 HydrophobicContact CB-CD2 3.87Å; R42-L234 HydrophobicContact CG-CD2 4.07Å
43	E	95.8	Very high	93.2	Very high	70 Å²	70	36.5 Å²	36.5	33%	0.327	18%	0.177	S	C	.	.	H	α-helix	trans	-65.1	-46	174.5	-67.1	176.4	-177.1	0	0	112.2	C39 V40 T46 E47 A64 R532	C39-E43 PolarHBondContact O-N 3.36Å; C39-E43 VanDerWaalsContact O-N 3.08Å; V40-E43 PolarHBondContact O-N 3.14Å; E43-T46 PolarHBondContact O-N 3.3Å; E43-E47 WeakPolarHBondContact O-CB 3.46Å; E43-E47 PolarHBondContact O-N 3.11Å; E43-A64 HydrophobicContact CB-CB 4.34Å; E43-A64 HydrophobicContact CG-CB 3.79Å; E43-R532 IonicContact OE2-CZ 3.79Å; E43-R532 IonicContact OE2-NH1 2.77Å; E43-R532 PolarHBondContact OE2-NH1 2.95Å
44	D	96.6	Very high	93.2	Very high	5 Å²	5	30.5 Å²	30.5	3%	0.027	15%	0.146	C	C	.	.	H	α-helix	trans	-59.3	-46.8	176.9	-170.5	41	0	0	0	111.7	V40 V41 T46 E47 W48 P253 Y254 L255 F531	V40-D44 PolarHBondContact O-N 3.4Å; V40-D44 VanDerWaalsContact O-N 3.09Å; V41-D44 PolarHBondContact O-N 2.84Å; D44-T46 PolarHBondContact O-N 3.23Å; D44-E47 PolarHBondContact O-N 3.29Å; D44-W48 VanDerWaalsContact O-CB 3.24Å; D44-W48 WeakPolarHBondContact O-CB 3.43Å; D44-W48 PolarHBondContact O-N 3.45Å; D44-P253 WeakPolarHBondContact OD2-CB 3.24Å; D44-Y254 VanDerWaalsContact OD1-CB 3.31Å; D44-Y254 WeakPolarHBondContact OD1-CB 3.35Å; D44-Y254 PolarHBondContact OD1-N 3.04Å; D44-Y254 PolarHBondContact OD2-N 3.19Å; D44-L255 HydrophobicContact CB-CD1 4.01Å; D44-L255 HydrophobicContact CB-CG 4.11Å; D44-L255 VanDerWaalsContact OD2-CB 3.26Å; D44-L255 WeakPolarHBondContact OD2-CB 3.47Å; D44-L255 VanDerWaalsContact OD2-CG 3.26Å; D44-L255 WeakPolarHBondContact OD2-CG 3.27Å; D44-L255 PolarHBondContact OD2-N 3.4Å; D44-F531 HydrophobicContact CB-CE1 3.91Å; D44-F531 HydrophobicContact CB-CZ 3.77Å
45	L	97	Very high	92.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.1	-32.4	176	-75	177.6	0	0	0	113.3	V41 W48 L49 L234 L237 M238 P253	V41-L45 HydrophobicContact CG1-CD1 3.95Å; V41-L45 HydrophobicContact CG1-CG 4.37Å; V41-L45 WeakPolarHBondContact O-CB 3.47Å; V41-L45 WeakPolarHBondContact O-CG 3.46Å; V41-L45 PolarHBondContact O-N 3.19Å; L45-W48 HydrophobicContact CD2-CE3 3.79Å; L45-W48 HydrophobicContact CD2-CZ3 4.07Å; L45-L49 VanDerWaalsContact O-CB 3.24Å; L45-L49 WeakPolarHBondContact O-CB 3.27Å; L45-L49 WeakPolarHBondContact O-CD1 3.43Å; L45-L49 WeakPolarHBondContact O-CG 3.33Å; L45-L49 PolarHBondContact O-N 2.88Å; L45-L234 HydrophobicContact CD1-CB 4.09Å; L45-L234 HydrophobicContact CD1-CD2 3.7Å; L45-L234 WeakPolarHBondContact CD1-O 3.36Å; L45-L237 HydrophobicContact CD1-CB 3.77Å; L45-L237 HydrophobicContact CD1-CD1 4.3Å; L45-L237 HydrophobicContact CD2-CB 4.01Å; L45-M238 HydrophobicContact CD1-CG 4.12Å; L45-M238 HydrophobicContact CD2-CG 4.44Å; L45-M238 HydrophobicContact CD2-SD 4.09Å; L45-M238 HydrophobicContact CG-CG 4.49Å; L45-M238 HydrophobicContact CG-SD 4.29Å; L45-P253 HydrophobicContact CD2-CB 4.39Å; L45-P253 HydrophobicContact CD2-CG 3.95Å
46	T	94.9	Very high	90.8	Very high	4 Å²	4	37.9 Å²	37.9	3%	0.025	20%	0.197	C	C	.	.	H	α-helix	trans	-68.2	-50.3	176.2	-55.4	0	0	0	0	110.2	R42 E43 D44 W48 L49 Q50 I62	R42-T46 WeakPolarHBondContact O-CB 3.39Å; R42-T46 PolarHBondContact O-N 3.27Å; R42-T46 PolarHBondContact O-OG1 3.32Å; E43-T46 PolarHBondContact O-N 3.3Å; D44-T46 PolarHBondContact O-N 3.23Å; T46-W48 PolarHBondContact O-N 3.13Å; T46-L49 PolarHBondContact O-N 3.02Å; T46-Q50 WeakPolarHBondContact O-CG 3.18Å; T46-Q50 PolarHBondContact O-N 2.98Å; T46-I62 WeakPolarHBondContact CG2-O 3.4Å
47	E	93.1	Very high	89.3	Confident	120 Å²	120	35 Å²	35	56%	0.561	19%	0.191	S	C	*	.	H	α-helix	trans	-60.6	-46.4	178.7	-169.4	177.4	161.7	0	0	111.2	E43 D44 Q50 H51 R532	E43-E47 WeakPolarHBondContact O-CB 3.46Å; E43-E47 PolarHBondContact O-N 3.11Å; D44-E47 PolarHBondContact O-N 3.29Å; E47-Q50 PolarHBondContact O-N 3.42Å; E47-H51 WeakPolarHBondContact O-CB 3.47Å; E47-H51 PolarHBondContact O-N 3.28Å; E47-R532 IonicContact OE2-CZ 2.72Å; E47-R532 IonicContact OE2-NE 2.45Å; E47-R532 IonicContact OE2-NH2 3.07Å; E47-R532 PolarHBondContact OE2-NH2 3.09Å
48	W	95.3	Very high	87.7	Confident	9 Å²	9	43.8 Å²	43.8	3%	0.034	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-47.1	175.4	173.4	65.7	0	0	0	112.7	D44 L45 T46 Q50 H51 Y52 L80 A241 L249 D251 P253	D44-W48 VanDerWaalsContact O-CB 3.24Å; D44-W48 WeakPolarHBondContact O-CB 3.43Å; D44-W48 PolarHBondContact O-N 3.45Å; L45-W48 HydrophobicContact CD2-CE3 3.79Å; L45-W48 HydrophobicContact CD2-CZ3 4.07Å; T46-W48 PolarHBondContact O-N 3.13Å; W48-Q50 VanDerWaalsContact C-N 3.31Å; W48-Q50 PolarHBondContact O-N 2.91Å; W48-H51 PolarHBondContact O-N 3.08Å; W48-Y52 HydrophobicContact CZ2-CD1 4.33Å; W48-Y52 WeakPolarHBondContact O-CB 3.45Å; W48-Y52 PolarHBondContact O-N 2.95Å; W48-L80 HydrophobicContact CH2-CD1 3.78Å; W48-L80 HydrophobicContact CZ2-CD1 4.33Å; W48-L80 HydrophobicContact CZ3-CD1 4.3Å; W48-A241 HydrophobicContact CH2-CB 3.93Å; W48-A241 HydrophobicContact CZ2-CB 4.21Å; W48-A241 HydrophobicContact CZ3-CB 4.43Å; W48-L249 HydrophobicContact CZ2-CD2 4.23Å; W48-D251 PolarHBondContact NE1-O 2.69Å; W48-P253 HydrophobicContact CB-CB 4.29Å; W48-P253 HydrophobicContact CB-CG 4.3Å; W48-P253 HydrophobicContact CD2-CB 4.48Å; W48-P253 HydrophobicContact CD2-CG 3.57Å; W48-P253 HydrophobicContact CE3-CG 3.74Å; W48-P253 HydrophobicContact CG-CB 4.25Å; W48-P253 HydrophobicContact CG-CG 3.8Å; W48-P253 HydrophobicContact CZ2-CG 4.49Å; W48-P253 HydrophobicContact CZ3-CG 4.26Å
49	L	94.8	Very high	86.4	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-65.4	-35.5	178.8	-73.3	171.4	0	0	0	112	L45 T46 L53 L67 L71 W76 L80 L237	L45-L49 VanDerWaalsContact O-CB 3.24Å; L45-L49 WeakPolarHBondContact O-CB 3.27Å; L45-L49 WeakPolarHBondContact O-CD1 3.43Å; L45-L49 WeakPolarHBondContact O-CG 3.33Å; L45-L49 PolarHBondContact O-N 2.88Å; T46-L49 PolarHBondContact O-N 3.02Å; L49-L53 HydrophobicContact CD2-CD1 4.21Å; L49-L53 HydrophobicContact CD2-CG 4.45Å; L49-L53 WeakPolarHBondContact O-CB 3.2Å; L49-L53 VanDerWaalsContact O-CG 3.27Å; L49-L53 WeakPolarHBondContact O-CG 3.39Å; L49-L53 PolarHBondContact O-N 3.25Å; L49-L67 HydrophobicContact CD1-CD1 3.91Å; L49-L71 HydrophobicContact CD1-CD2 4.24Å; L49-W76 HydrophobicContact CB-CE3 4.25Å; L49-W76 HydrophobicContact CB-CZ3 4.11Å; L49-L80 HydrophobicContact CD2-CD1 3.86Å; L49-L80 HydrophobicContact CD2-CD2 3.86Å; L49-L80 HydrophobicContact CD2-CG 4.33Å; L49-L237 HydrophobicContact CD1-CD1 4.18Å
50	Q	90	Very high	85.3	Confident	28 Å²	28	46.1 Å²	46.1	13%	0.131	26%	0.257	C	S	.	.	H	α-helix	trans	-65.8	-48.7	174.9	-71	-154.2	-90.1	0	0	112	T46 E47 W48 F54 C60 W76	T46-Q50 WeakPolarHBondContact O-CG 3.18Å; T46-Q50 PolarHBondContact O-N 2.98Å; E47-Q50 PolarHBondContact O-N 3.42Å; W48-Q50 VanDerWaalsContact C-N 3.31Å; W48-Q50 PolarHBondContact O-N 2.91Å; Q50-F54 WeakPolarHBondContact O-CB 3.4Å; Q50-F54 PolarHBondContact O-N 3.03Å; Q50-F54 VanDerWaalsContact O-N 3.09Å; Q50-C60 PolarHBondContact NE2-O 3.19Å; Q50-W76 HydrophobicContact CG-CH2 3.91Å; Q50-W76 HydrophobicContact CG-CZ3 4.32Å
51	H	89	Confident	84.6	Confident	107 Å²	107	51 Å²	51	50%	0.495	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-53.1	176.3	-176.6	-102.6	0	0	0	111.6	E47 W48 L53 S55 D251	E47-H51 WeakPolarHBondContact O-CB 3.47Å; E47-H51 PolarHBondContact O-N 3.28Å; W48-H51 PolarHBondContact O-N 3.08Å; H51-L53 PolarHBondContact O-N 3.43Å; H51-S55 VanDerWaalsContact O-CB 3.27Å; H51-S55 WeakPolarHBondContact O-CB 3.32Å; H51-S55 PolarHBondContact O-N 3.42Å; H51-S55 VanDerWaalsContact O-N 3.07Å; H51-D251 IonicContact CE1-OD1 2.93Å; H51-D251 IonicContact CE1-OD2 3.59Å; H51-D251 PolarHBondContact CE1-OD2 3.45Å; H51-D251 IonicContact ND1-OD1 3.57Å; H51-D251 IonicContact ND1-OD2 3.68Å; H51-D251 PolarHBondContact ND1-OD2 3.24Å
52	Y	91.9	Very high	84	Confident	12 Å²	12	51.2 Å²	51.2	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-70.8	-33.6	-171.5	-171.6	-107	0	0	0	113.5	W48 L80 K83 L84 L249 D251	W48-Y52 HydrophobicContact CZ2-CD1 4.33Å; W48-Y52 WeakPolarHBondContact O-CB 3.45Å; W48-Y52 PolarHBondContact O-N 2.95Å; Y52-L80 HydrophobicContact CD1-CD1 3.97Å; Y52-L80 HydrophobicContact CE1-CD1 4.14Å; Y52-K83 HydrophobicContact CD1-CD 4.27Å; Y52-K83 HydrophobicContact CE1-CB 4.41Å; Y52-K83 HydrophobicContact CE1-CD 3.71Å; Y52-K83 HydrophobicContact CE1-CG 4.02Å; Y52-K83 HydrophobicContact CE2-CD 4.4Å; Y52-K83 PolarHBondContact O-NZ 3.07Å; Y52-L84 HydrophobicContact CE1-CD2 3.85Å; Y52-L84 HydrophobicContact CE1-CG 4.23Å; Y52-L249 HydrophobicContact CD2-CD1 4.45Å; Y52-L249 HydrophobicContact CE2-CD1 3.63Å; Y52-D251 HydrophobicContact CD2-CB 4.3Å
53	L	89.9	Confident	83.6	Confident	19 Å²	19	54.4 Å²	54.4	10%	0.099	31%	0.306	C	S	.	.	H	α-helix	trans	-90.4	-26.5	179.4	-57.5	-176.2	0	0	0	113.8	L49 H51 W76 R79 L80	L49-L53 HydrophobicContact CD2-CD1 4.21Å; L49-L53 HydrophobicContact CD2-CG 4.45Å; L49-L53 WeakPolarHBondContact O-CB 3.2Å; L49-L53 VanDerWaalsContact O-CG 3.27Å; L49-L53 WeakPolarHBondContact O-CG 3.39Å; L49-L53 PolarHBondContact O-N 3.25Å; H51-L53 PolarHBondContact O-N 3.43Å; L53-W76 HydrophobicContact CD1-CB 4.25Å; L53-W76 HydrophobicContact CD1-CE3 4.37Å; L53-W76 HydrophobicContact CD1-CG 4.49Å; L53-W76 WeakPolarHBondContact CD1-O 3.31Å; L53-R79 HydrophobicContact CD2-CB 4.43Å; L53-L80 HydrophobicContact CD2-CB 4.03Å; L53-L80 HydrophobicContact CD2-CD1 4.11Å
54	F	83	Confident	83.3	Confident	7 Å²	7	51.9 Å²	51.9	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-129.4	17.5	-167.8	-47.6	-60.1	0	0	0	115.1	Q50 T56 A57 A59 W76 L152	Q50-F54 WeakPolarHBondContact O-CB 3.4Å; Q50-F54 PolarHBondContact O-N 3.03Å; Q50-F54 VanDerWaalsContact O-N 3.09Å; F54-T56 PolarHBondContact O-N 3.39Å; F54-A57 PolarHBondContact O-N 2.85Å; F54-A59 HydrophobicContact CB-CB 3.95Å; F54-A59 HydrophobicContact CD2-CB 4.39Å; F54-A59 HydrophobicContact CG-CB 4.25Å; F54-W76 HydrophobicContact CD2-CZ2 4.47Å; F54-W76 AromaticContact CE2-CD2 3.91Å; F54-W76 HydrophobicContact CE2-CD2 3.91Å; F54-W76 AromaticContact CE2-CE2 3.53Å; F54-W76 HydrophobicContact CE2-CE3 4.2Å; F54-W76 AromaticContact CE2-CH2 3.86Å; F54-W76 HydrophobicContact CE2-CH2 3.86Å; F54-W76 AromaticContact CE2-CZ2 3.51Å; F54-W76 HydrophobicContact CE2-CZ2 3.51Å; F54-W76 HydrophobicContact CE2-CZ3 4.18Å; F54-W76 AromaticContact CZ-CD2 3.99Å; F54-W76 HydrophobicContact CZ-CD2 3.99Å; F54-W76 AromaticContact CZ-CE2 3.67Å; F54-W76 HydrophobicContact CZ-CG 4.23Å; F54-W76 HydrophobicContact CZ-CZ2 4.1Å; F54-W76 AromaticContact CZ-NE1 3.68Å; F54-L152 HydrophobicContact CD1-CD1 3.77Å; F54-L152 HydrophobicContact CE1-CD1 3.64Å; F54-L152 HydrophobicContact CE1-CD2 3.8Å; F54-L152 HydrophobicContact CE1-CG 4.34Å; F54-L152 HydrophobicContact CZ-CD2 4.24Å
55	S	69.2	Low	82.9	Confident	79 Å²	79	56.8 Å²	56.8	55%	0.552	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-16.5	175.6	56.6	0	0	0	0	115.9	H51	H51-S55 VanDerWaalsContact O-CB 3.27Å; H51-S55 WeakPolarHBondContact O-CB 3.32Å; H51-S55 PolarHBondContact O-N 3.42Å; H51-S55 VanDerWaalsContact O-N 3.07Å
56	T	59.6	Low	82.5	Confident	141 Å²	141	59.7 Å²	59.7	87%	0.865	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	3.4	175.3	55.2	0	0	0	0	114.3	F54	F54-T56 PolarHBondContact O-N 3.39Å
57	A	62.1	Low	82.4	Confident	44 Å²	44	59.5 Å²	59.5	36%	0.364	33%	0.33	S	S	.	.	S	Bend	trans	-132.1	140.3	-178.4	0	0	0	0	0	111	F54 A59	F54-A57 PolarHBondContact O-N 2.85Å; A57-A59 PolarHBondContact O-N 3.18Å
58	N	60.3	Low	82.3	Confident	183 Å²	183	54 Å²	54	98%	0.979	30%	0.304	S	S	*	.			trans	-74.7	61.9	175.1	-70.3	-10.3	0	0	0	111.2
59	A	67.6	Low	82	Confident	23 Å²	23	56 Å²	56	19%	0.19	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-71.5	130.9	171.8	0	0	0	0	0	109.6	F54 A57 L157	F54-A59 HydrophobicContact CB-CB 3.95Å; F54-A59 HydrophobicContact CD2-CB 4.39Å; F54-A59 HydrophobicContact CG-CB 4.25Å; A57-A59 PolarHBondContact O-N 3.18Å; A59-L157 HydrophobicContact CB-CD2 3.69Å
60	C	72.1	Confident	81.6	Confident	69 Å²	69	56.6 Å²	56.6	47%	0.466	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-62.4	140.5	173.8	-174.2	0	0	0	0	109.8	Q50 I62	Q50-C60 PolarHBondContact NE2-O 3.19Å; C60-I62 PolarHBondContact O-N 3.45Å
61	P	80.9	Confident	81.8	Confident	103 Å²	103	55.3 Å²	55.3	67%	0.669	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-52.2	140	166.9	-28.4	36.6	0	0	0	111.9	S159	P61-S159 PolarHBondContact O-OG 3.04Å
62	I	84.5	Confident	81.9	Confident	11 Å²	11	51.1 Å²	51.1	6%	0.056	30%	0.3	C	S	.	.			trans	-118.6	122.9	-175.4	-70.2	162.3	0	0	0	108	T46 C60 A64 R70 W76 S159	T46-I62 WeakPolarHBondContact CG2-O 3.4Å; C60-I62 PolarHBondContact O-N 3.45Å; I62-A64 PolarHBondContact O-N 2.86Å; I62-R70 HydrophobicContact CD1-CG 4.25Å; I62-R70 VanDerWaalsContact CD1-NE 3.3Å; I62-R70 HydrophobicContact CG2-CG 4.5Å; I62-W76 HydrophobicContact CD1-CH2 3.55Å; I62-W76 HydrophobicContact CD1-CZ2 3.5Å; I62-S159 WeakPolarHBondContact CG1-OG 3.38Å
63	E	87.4	Confident	81.6	Confident	107 Å²	107	52.4 Å²	52.4	50%	0.5	31%	0.31	S	S	.	.			trans	-64.2	135.5	178.1	-55.2	179.8	126	0	0	109.8	H65 Y66	E63-H65 VanDerWaalsContact CB-NE2 3.3Å; E63-H65 WeakPolarHBondContact CB-NE2 3.34Å; E63-H65 PolarHBondContact O-N 2.86Å; E63-H65 IonicContact OE1-NE2 3.9Å; E63-H65 IonicContact OE2-NE2 3.44Å; E63-H65 PolarHBondContact OE2-NE2 3.49Å; E63-Y66 HydrophobicContact CB-CD2 4.06Å; E63-Y66 HydrophobicContact CB-CE2 4.44Å; E63-Y66 WeakPolarHBondContact O-CB 3.45Å; E63-Y66 PolarHBondContact O-N 2.75Å
64	A	90.5	Very high	81.7	Confident	17 Å²	17	51.5 Å²	51.5	14%	0.14	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-56.9	-27	-165.1	0	0	0	0	0	114.8	R42 E43 I62 Y66 L67	R42-A64 VanDerWaalsContact CD-O 3.27Å; R42-A64 WeakPolarHBondContact CD-O 3.27Å; R42-A64 HydrophobicContact CG-CB 4.2Å; R42-A64 WeakPolarHBondContact CG-O 3.4Å; E43-A64 HydrophobicContact CB-CB 4.34Å; E43-A64 HydrophobicContact CG-CB 3.79Å; I62-A64 PolarHBondContact O-N 2.86Å; A64-Y66 PolarHBondContact O-N 2.89Å; A64-L67 VanDerWaalsContact O-CB 3.27Å; A64-L67 WeakPolarHBondContact O-CB 3.16Å; A64-L67 PolarHBondContact O-N 3.25Å
65	H	88.4	Confident	82.1	Confident	108 Å²	108	51.6 Å²	51.6	50%	0.5	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-70.6	-15.4	176.6	65.8	-97.8	0	0	0	113.8	E63	E63-H65 VanDerWaalsContact CB-NE2 3.3Å; E63-H65 WeakPolarHBondContact CB-NE2 3.34Å; E63-H65 PolarHBondContact O-N 2.86Å; E63-H65 IonicContact OE1-NE2 3.9Å; E63-H65 IonicContact OE2-NE2 3.44Å; E63-H65 PolarHBondContact OE2-NE2 3.49Å
66	Y	88.8	Confident	83.3	Confident	61 Å²	61	47.9 Å²	47.9	24%	0.239	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-86.1	-6.2	171.4	-68.6	-60.1	0	0	0	113.9	E63 A64 L68 C69 R70	E63-Y66 HydrophobicContact CB-CD2 4.06Å; E63-Y66 HydrophobicContact CB-CE2 4.44Å; E63-Y66 WeakPolarHBondContact O-CB 3.45Å; E63-Y66 PolarHBondContact O-N 2.75Å; A64-Y66 PolarHBondContact O-N 2.89Å; Y66-L68 PolarHBondContact O-N 2.81Å; Y66-C69 WeakPolarHBondContact O-CA 3.24Å; Y66-C69 WeakPolarHBondContact O-CB 3.47Å; Y66-C69 PolarHBondContact O-N 3.36Å; Y66-R70 PolarHBondContact O-N 3.49Å
67	L	91.7	Very high	85	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-49.3	-53.3	-176	177.2	62.4	0	0	0	112.4	R42 L49 A64 C69 R70 L71 W76 L234	R42-L67 HydrophobicContact CG-CB 4.47Å; R42-L67 HydrophobicContact CG-CD2 4.01Å; L49-L67 HydrophobicContact CD1-CD1 3.91Å; A64-L67 VanDerWaalsContact O-CB 3.27Å; A64-L67 WeakPolarHBondContact O-CB 3.16Å; A64-L67 PolarHBondContact O-N 3.25Å; L67-C69 PolarHBondContact O-N 3.01Å; L67-C69 VanDerWaalsContact O-N 3.16Å; L67-R70 WeakPolarHBondContact O-CB 3.39Å; L67-R70 PolarHBondContact O-N 3.1Å; L67-L71 HydrophobicContact CD1-CD1 4.05Å; L67-L71 HydrophobicContact CD1-CD2 4.28Å; L67-L71 HydrophobicContact CD1-CG 4.04Å; L67-L71 HydrophobicContact CD2-CD1 4.4Å; L67-L71 HydrophobicContact CG-CD1 3.9Å; L67-L71 HydrophobicContact CG-CG 4.24Å; L67-L71 WeakPolarHBondContact O-CG 3.5Å; L67-L71 PolarHBondContact O-N 3.06Å; L67-W76 HydrophobicContact CD1-CZ3 4.42Å; L67-L234 HydrophobicContact CD2-CD2 3.89Å
68	L	92.1	Very high	86.6	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-60.5	-26.9	179.2	-95.5	61.8	0	0	0	113.4	Y66 R70 A72 L224 K227 E230 V233	Y66-L68 PolarHBondContact O-N 2.81Å; L68-R70 VanDerWaalsContact C-N 3.32Å; L68-A72 VanDerWaalsContact O-CB 3.24Å; L68-A72 WeakPolarHBondContact O-CB 3.44Å; L68-A72 PolarHBondContact O-N 3.22Å; L68-A72 VanDerWaalsContact O-N 3.12Å; L68-L224 HydrophobicContact CB-CD1 4.32Å; L68-L224 HydrophobicContact CG-CD1 3.86Å; L68-K227 HydrophobicContact CB-CG 4.36Å; L68-K227 HydrophobicContact CD2-CB 3.99Å; L68-K227 HydrophobicContact CD2-CG 4.2Å; L68-E230 HydrophobicContact CD1-CB 4.49Å; L68-E230 HydrophobicContact CD1-CG 3.76Å; L68-E230 HydrophobicContact CD2-CB 3.65Å; L68-E230 HydrophobicContact CD2-CG 3.7Å; L68-E230 HydrophobicContact CG-CG 4.38Å; L68-V233 HydrophobicContact CD1-CG1 4.32Å
69	C	88.1	Confident	88.2	Confident	53 Å²	53	32 Å²	32	36%	0.358	18%	0.181	S	C	.	.	H	α-helix	trans	-69.5	-31.6	175.9	-50.4	0	0	0	0	111.9	Y66 L67 K227	Y66-C69 WeakPolarHBondContact O-CA 3.24Å; Y66-C69 WeakPolarHBondContact O-CB 3.47Å; Y66-C69 PolarHBondContact O-N 3.36Å; L67-C69 PolarHBondContact O-N 3.01Å; L67-C69 VanDerWaalsContact O-N 3.16Å; C69-K227 PolarHBondContact SG-NZ 3.25Å
70	R	87.2	Confident	89.6	Confident	12 Å²	12	30.9 Å²	30.9	5%	0.045	17%	0.172	C	C	.	.	H	α-helix	trans	-80	-43.5	175.7	-53.6	-62.2	-174.8	-164	-2.7	111.9	I62 Y66 L67 L68 A72 S73 W76 S155 C158	I62-R70 HydrophobicContact CD1-CG 4.25Å; I62-R70 VanDerWaalsContact CD1-NE 3.3Å; I62-R70 HydrophobicContact CG2-CG 4.5Å; Y66-R70 PolarHBondContact O-N 3.49Å; L67-R70 WeakPolarHBondContact O-CB 3.39Å; L67-R70 PolarHBondContact O-N 3.1Å; L68-R70 VanDerWaalsContact C-N 3.32Å; R70-A72 PolarHBondContact O-N 3.24Å; R70-S73 PolarHBondContact O-N 3.44Å; R70-S73 PolarHBondContact O-OG 2.97Å; R70-W76 HydrophobicContact CB-CD2 3.76Å; R70-W76 HydrophobicContact CB-CE3 4.16Å; R70-W76 HydrophobicContact CB-CG 4.17Å; R70-W76 HydrophobicContact CB-CH2 4.28Å; R70-W76 HydrophobicContact CB-CZ2 3.89Å; R70-W76 HydrophobicContact CB-CZ3 4.41Å; R70-W76 HydrophobicContact CG-CH2 4.05Å; R70-W76 HydrophobicContact CG-CZ2 3.72Å; R70-S155 PolarHBondContact NH1-O 3.21Å; R70-C158 PolarHBondContact NH1-O 3.16Å; R70-C158 PolarHBondContact NH2-O 3.03Å
71	L	93.2	Very high	90.7	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-63.8	-30.2	179.4	-59.3	-177.2	0	0	0	112	L49 L67 S73 G74 W76 L77 L224 V233 L237	L49-L71 HydrophobicContact CD1-CD2 4.24Å; L67-L71 HydrophobicContact CD1-CD1 4.05Å; L67-L71 HydrophobicContact CD1-CD2 4.28Å; L67-L71 HydrophobicContact CD1-CG 4.04Å; L67-L71 HydrophobicContact CD2-CD1 4.4Å; L67-L71 HydrophobicContact CG-CD1 3.9Å; L67-L71 HydrophobicContact CG-CG 4.24Å; L67-L71 WeakPolarHBondContact O-CG 3.5Å; L67-L71 PolarHBondContact O-N 3.06Å; L71-S73 PolarHBondContact O-N 3.48Å; L71-G74 PolarHBondContact O-N 3.41Å; L71-W76 HydrophobicContact CD2-CB 3.83Å; L71-W76 HydrophobicContact CD2-CE3 4.28Å; L71-L77 HydrophobicContact CB-CD1 4.41Å; L71-L77 HydrophobicContact CB-CG 4.32Å; L71-L77 HydrophobicContact CD1-CD2 4.45Å; L71-L77 HydrophobicContact CD2-CD2 3.83Å; L71-L77 HydrophobicContact CD2-CG 4.1Å; L71-L77 HydrophobicContact CG-CD2 4.48Å; L71-L224 HydrophobicContact CB-CD1 4Å; L71-L224 HydrophobicContact CB-CD2 4.06Å; L71-V233 HydrophobicContact CD1-CG1 3.57Å; L71-L237 HydrophobicContact CD1-CD1 3.86Å
72	A	90.6	Very high	91.4	Very high	20 Å²	20	25.4 Å²	25.4	17%	0.165	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-9.6	179.6	0	0	0	0	0	115.9	L68 R70 G74 M225	L68-A72 VanDerWaalsContact O-CB 3.24Å; L68-A72 WeakPolarHBondContact O-CB 3.44Å; L68-A72 PolarHBondContact O-N 3.22Å; L68-A72 VanDerWaalsContact O-N 3.12Å; R70-A72 PolarHBondContact O-N 3.24Å; A72-G74 VanDerWaalsContact C-N 3.28Å; A72-M225 HydrophobicContact CB-SD 4.09Å
73	S	87.1	Confident	91.8	Very high	38 Å²	38	28 Å²	28	27%	0.266	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-13.9	167	68.3	0	0	0	0	112.6	R70 L71 L75 D156	R70-S73 PolarHBondContact O-N 3.44Å; R70-S73 PolarHBondContact O-OG 2.97Å; L71-S73 PolarHBondContact O-N 3.48Å; S73-L75 PolarHBondContact O-N 3.34Å; S73-L75 WeakPolarHBondContact OG-CB 3.39Å; S73-L75 PolarHBondContact OG-N 3.5Å; S73-D156 PolarHBondContact OG-OD1 3.4Å
74	G	92.1	Very high	92.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	73.7	-12.3	-169.5	0	0	0	0	0	114.1	L71 A72 L77 S78	L71-G74 PolarHBondContact O-N 3.41Å; A72-G74 VanDerWaalsContact C-N 3.28Å; G74-L77 PolarHBondContact O-N 3.22Å; G74-S78 VanDerWaalsContact O-CB 3.32Å; G74-S78 WeakPolarHBondContact O-CB 3.36Å; G74-S78 PolarHBondContact O-N 3.48Å; G74-S78 PolarHBondContact O-OG 3.08Å
75	L	91.3	Very high	92.3	Very high	9 Å²	9	22.8 Å²	22.8	5%	0.047	11%	0.112	C	C	.	.	H	α-helix	trans	-67.7	-47.6	-174.1	-179	55.5	0	0	0	112.5	S73 L77 S78 R79 C147 L150 L152 D156	S73-L75 PolarHBondContact O-N 3.34Å; S73-L75 WeakPolarHBondContact OG-CB 3.39Å; S73-L75 PolarHBondContact OG-N 3.5Å; L75-L77 VanDerWaalsContact C-N 3.34Å; L75-L77 PolarHBondContact O-N 3.27Å; L75-S78 PolarHBondContact O-N 2.92Å; L75-R79 HydrophobicContact CD1-CG 4.3Å; L75-R79 WeakPolarHBondContact O-CB 3.38Å; L75-R79 WeakPolarHBondContact O-CG 3.35Å; L75-R79 PolarHBondContact O-N 3.05Å; L75-C147 WeakPolarHBondContact CD1-O 3.34Å; L75-L150 HydrophobicContact CD1-CB 4.11Å; L75-L152 HydrophobicContact CD2-CD2 3.91Å; L75-L152 HydrophobicContact CG-CD2 4.47Å; L75-D156 HydrophobicContact CD2-CB 4.36Å
76	W	93.7	Very high	92.4	Very high	2 Å²	2	22 Å²	22	1%	0.008	11%	0.105	C	C	.	.	H	α-helix	trans	-61.1	-42.6	176.6	-79.4	45.6	0	0	0	111.7	L49 Q50 L53 F54 I62 L67 R70 L71 R79 L80 D156	L49-W76 HydrophobicContact CB-CE3 4.25Å; L49-W76 HydrophobicContact CB-CZ3 4.11Å; Q50-W76 HydrophobicContact CG-CH2 3.91Å; Q50-W76 HydrophobicContact CG-CZ3 4.32Å; L53-W76 HydrophobicContact CD1-CB 4.25Å; L53-W76 HydrophobicContact CD1-CE3 4.37Å; L53-W76 HydrophobicContact CD1-CG 4.49Å; L53-W76 WeakPolarHBondContact CD1-O 3.31Å; F54-W76 HydrophobicContact CD2-CZ2 4.47Å; F54-W76 AromaticContact CE2-CD2 3.91Å; F54-W76 HydrophobicContact CE2-CD2 3.91Å; F54-W76 AromaticContact CE2-CE2 3.53Å; F54-W76 HydrophobicContact CE2-CE3 4.2Å; F54-W76 AromaticContact CE2-CH2 3.86Å; F54-W76 HydrophobicContact CE2-CH2 3.86Å; F54-W76 AromaticContact CE2-CZ2 3.51Å; F54-W76 HydrophobicContact CE2-CZ2 3.51Å; F54-W76 HydrophobicContact CE2-CZ3 4.18Å; F54-W76 AromaticContact CZ-CD2 3.99Å; F54-W76 HydrophobicContact CZ-CD2 3.99Å; F54-W76 AromaticContact CZ-CE2 3.67Å; F54-W76 HydrophobicContact CZ-CG 4.23Å; F54-W76 HydrophobicContact CZ-CZ2 4.1Å; F54-W76 AromaticContact CZ-NE1 3.68Å; I62-W76 HydrophobicContact CD1-CH2 3.55Å; I62-W76 HydrophobicContact CD1-CZ2 3.5Å; L67-W76 HydrophobicContact CD1-CZ3 4.42Å; R70-W76 HydrophobicContact CB-CD2 3.76Å; R70-W76 HydrophobicContact CB-CE3 4.16Å; R70-W76 HydrophobicContact CB-CG 4.17Å; R70-W76 HydrophobicContact CB-CH2 4.28Å; R70-W76 HydrophobicContact CB-CZ2 3.89Å; R70-W76 HydrophobicContact CB-CZ3 4.41Å; R70-W76 HydrophobicContact CG-CH2 4.05Å; R70-W76 HydrophobicContact CG-CZ2 3.72Å; L71-W76 HydrophobicContact CD2-CB 3.83Å; L71-W76 HydrophobicContact CD2-CE3 4.28Å; W76-R79 PolarHBondContact O-N 3.28Å; W76-L80 WeakPolarHBondContact O-CB 3.2Å; W76-L80 PolarHBondContact O-N 2.7Å; W76-D156 PolarHBondContact NE1-O 2.97Å
77	L	96.2	Very high	92.4	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-65.5	-42.4	177.3	-66	177.7	0	0	0	112	L71 G74 L75 L80 A81 V201 F204 F219 L224 L237	L71-L77 HydrophobicContact CB-CD1 4.41Å; L71-L77 HydrophobicContact CB-CG 4.32Å; L71-L77 HydrophobicContact CD1-CD2 4.45Å; L71-L77 HydrophobicContact CD2-CD2 3.83Å; L71-L77 HydrophobicContact CD2-CG 4.1Å; L71-L77 HydrophobicContact CG-CD2 4.48Å; G74-L77 PolarHBondContact O-N 3.22Å; L75-L77 VanDerWaalsContact C-N 3.34Å; L75-L77 PolarHBondContact O-N 3.27Å; L77-L80 PolarHBondContact O-N 3.22Å; L77-A81 WeakPolarHBondContact O-CB 3.37Å; L77-A81 PolarHBondContact O-N 2.69Å; L77-V201 HydrophobicContact CD1-CG2 4.19Å; L77-F204 HydrophobicContact CB-CB 4.22Å; L77-F204 HydrophobicContact CB-CD1 4.22Å; L77-F204 HydrophobicContact CB-CD2 3.71Å; L77-F204 HydrophobicContact CB-CE2 4.11Å; L77-F204 HydrophobicContact CB-CG 3.77Å; L77-F204 HydrophobicContact CD1-CD1 4Å; L77-F204 HydrophobicContact CD1-CE1 4.43Å; L77-F204 HydrophobicContact CD1-CG 4.27Å; L77-F204 HydrophobicContact CD2-CD1 4.13Å; L77-F204 HydrophobicContact CD2-CD2 4.5Å; L77-F204 HydrophobicContact CD2-CE1 3.79Å; L77-F204 HydrophobicContact CD2-CE2 4.18Å; L77-F204 HydrophobicContact CD2-CG 4.48Å; L77-F204 HydrophobicContact CD2-CZ 3.82Å; L77-F204 HydrophobicContact CG-CD1 4.35Å; L77-F204 HydrophobicContact CG-CE1 4.5Å; L77-F204 HydrophobicContact CG-CG 4.4Å; L77-F204 WeakPolarHBondContact O-CD2 3.37Å; L77-F219 HydrophobicContact CD1-CZ 4.21Å; L77-L224 HydrophobicContact CD1-CD2 3.73Å; L77-L237 HydrophobicContact CD2-CD2 4.07Å
78	S	95.3	Very high	92.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-43.4	177.2	-57.3	0	0	0	0	111.6	G74 L75 A81 Y82 L144 C147	G74-S78 VanDerWaalsContact O-CB 3.32Å; G74-S78 WeakPolarHBondContact O-CB 3.36Å; G74-S78 PolarHBondContact O-N 3.48Å; G74-S78 PolarHBondContact O-OG 3.08Å; L75-S78 PolarHBondContact O-N 2.92Å; S78-A81 PolarHBondContact O-N 3.23Å; S78-Y82 VanDerWaalsContact O-CB 3.23Å; S78-Y82 WeakPolarHBondContact O-CB 3.48Å; S78-Y82 PolarHBondContact O-N 2.93Å; S78-L144 WeakPolarHBondContact OG-CD2 3.19Å; S78-C147 PolarHBondContact OG-SG 3.49Å; S78-C147 VanDerWaalsContact OG-SG 3.39Å
79	R	93.5	Very high	91.9	Very high	32 Å²	32	23.5 Å²	23.5	12%	0.121	12%	0.123	C	C	.	.	H	α-helix	trans	-64.2	-39.6	174.7	-74.3	179.8	167.7	-141.4	1.9	112.7	L53 L75 W76 K83 A148 L150	L53-R79 HydrophobicContact CD2-CB 4.43Å; L75-R79 HydrophobicContact CD1-CG 4.3Å; L75-R79 WeakPolarHBondContact O-CB 3.38Å; L75-R79 WeakPolarHBondContact O-CG 3.35Å; L75-R79 PolarHBondContact O-N 3.05Å; W76-R79 PolarHBondContact O-N 3.28Å; R79-K83 VanDerWaalsContact O-CB 3.31Å; R79-K83 WeakPolarHBondContact O-CB 3.21Å; R79-K83 PolarHBondContact O-N 3.01Å; R79-A148 HydrophobicContact CG-CB 4.07Å; R79-A148 WeakPolarHBondContact CG-O 3.33Å; R79-A148 PolarHBondContact NE-O 3.47Å; R79-A148 VanDerWaalsContact NE-O 3.14Å; R79-L150 PolarHBondContact NH2-O 2.9Å
80	L	95.9	Very high	91.7	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-61	-52.4	173.7	-179.2	67.3	0	0	0	111.1	W48 L49 Y52 L53 W76 L77 Y82 K83 L84 F204 L237	W48-L80 HydrophobicContact CH2-CD1 3.78Å; W48-L80 HydrophobicContact CZ2-CD1 4.33Å; W48-L80 HydrophobicContact CZ3-CD1 4.3Å; L49-L80 HydrophobicContact CD2-CD1 3.86Å; L49-L80 HydrophobicContact CD2-CD2 3.86Å; L49-L80 HydrophobicContact CD2-CG 4.33Å; Y52-L80 HydrophobicContact CD1-CD1 3.97Å; Y52-L80 HydrophobicContact CE1-CD1 4.14Å; L53-L80 HydrophobicContact CD2-CB 4.03Å; L53-L80 HydrophobicContact CD2-CD1 4.11Å; W76-L80 WeakPolarHBondContact O-CB 3.2Å; W76-L80 PolarHBondContact O-N 2.7Å; L77-L80 PolarHBondContact O-N 3.22Å; L80-Y82 PolarHBondContact O-N 2.9Å; L80-K83 PolarHBondContact O-N 2.86Å; L80-L84 HydrophobicContact CD1-CD1 3.77Å; L80-L84 HydrophobicContact CD1-CG 4.12Å; L80-L84 HydrophobicContact CG-CD1 3.84Å; L80-L84 HydrophobicContact CG-CG 4.46Å; L80-L84 WeakPolarHBondContact O-CB 3.48Å; L80-L84 VanDerWaalsContact O-CG 3.26Å; L80-L84 WeakPolarHBondContact O-CG 3.34Å; L80-L84 PolarHBondContact O-N 2.77Å; L80-F204 HydrophobicContact CD2-CE2 4.45Å; L80-F204 HydrophobicContact CD2-CZ 4.49Å; L80-L237 HydrophobicContact CD2-CD2 3.52Å
81	A	96.6	Very high	91.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.2	-46.1	179.5	0	0	0	0	0	111.9	L77 S78 L84 H85 F140 L144 F204 W207	L77-A81 WeakPolarHBondContact O-CB 3.37Å; L77-A81 PolarHBondContact O-N 2.69Å; S78-A81 PolarHBondContact O-N 3.23Å; A81-L84 PolarHBondContact O-N 2.67Å; A81-H85 VanDerWaalsContact O-CB 3.26Å; A81-H85 WeakPolarHBondContact O-CB 3.41Å; A81-H85 PolarHBondContact O-N 2.64Å; A81-F140 HydrophobicContact CB-CE2 3.88Å; A81-F140 HydrophobicContact CB-CZ 3.95Å; A81-L144 HydrophobicContact CB-CD1 4.05Å; A81-F204 HydrophobicContact CB-CD2 3.92Å; A81-F204 HydrophobicContact CB-CE2 4.13Å; A81-W207 HydrophobicContact CB-CD2 3.93Å; A81-W207 HydrophobicContact CB-CE3 3.59Å; A81-W207 HydrophobicContact CB-CH2 3.82Å; A81-W207 HydrophobicContact CB-CZ2 4.1Å; A81-W207 HydrophobicContact CB-CZ3 3.55Å
82	Y	94.8	Very high	89.9	Confident	56 Å²	56	28.8 Å²	28.8	22%	0.22	15%	0.152	C	C	.	.	H	α-helix	trans	-60	-51.1	178	-178.6	-95.7	0	0	0	111.8	S78 L80 L84 H85 Y86 F140 T145 A148 F452	S78-Y82 VanDerWaalsContact O-CB 3.23Å; S78-Y82 WeakPolarHBondContact O-CB 3.48Å; S78-Y82 PolarHBondContact O-N 2.93Å; L80-Y82 PolarHBondContact O-N 2.9Å; Y82-L84 PolarHBondContact O-N 3.39Å; Y82-H85 PolarHBondContact O-N 3.49Å; Y82-Y86 AromaticContact CD2-CD2 3.49Å; Y82-Y86 HydrophobicContact CD2-CD2 3.49Å; Y82-Y86 VanDerWaalsContact CD2-CD2 3.49Å; Y82-Y86 AromaticContact CD2-CE2 3.47Å; Y82-Y86 HydrophobicContact CD2-CE2 3.47Å; Y82-Y86 VanDerWaalsContact CD2-CE2 3.47Å; Y82-Y86 HydrophobicContact CE1-CD2 4.48Å; Y82-Y86 AromaticContact CE2-CD2 3.38Å; Y82-Y86 HydrophobicContact CE2-CD2 3.38Å; Y82-Y86 AromaticContact CE2-CE2 3.35Å; Y82-Y86 HydrophobicContact CE2-CE2 3.35Å; Y82-Y86 HydrophobicContact CE2-CG 4.44Å; Y82-Y86 HydrophobicContact CG-CD2 4.08Å; Y82-Y86 HydrophobicContact CG-CE2 4.44Å; Y82-Y86 AromaticContact CZ-CD2 3.91Å; Y82-Y86 WeakPolarHBondContact O-CD2 3.11Å; Y82-Y86 PolarHBondContact O-N 3.2Å; Y82-Y86 VanDerWaalsContact O-N 3.15Å; Y82-F140 AromaticContact CD2-CE1 3.95Å; Y82-F140 HydrophobicContact CD2-CE1 3.95Å; Y82-T145 HydrophobicContact CD2-CG2 4.45Å; Y82-T145 HydrophobicContact CE2-CG2 4.14Å; Y82-A148 HydrophobicContact CD1-CB 4.37Å; Y82-A148 HydrophobicContact CD2-CB 4.39Å; Y82-A148 HydrophobicContact CG-CB 3.89Å; Y82-F452 HydrophobicContact CE1-CE1 4.16Å
83	K	93.6	Very high	88.2	Confident	67 Å²	67	33.2 Å²	33.2	29%	0.291	17%	0.169	S	C	.	.	H	α-helix	trans	-64.6	-41.8	179.9	-173.5	175	174.1	178.3	0	111.8	Y52 R79 L80 S87	Y52-K83 HydrophobicContact CD1-CD 4.27Å; Y52-K83 HydrophobicContact CE1-CB 4.41Å; Y52-K83 HydrophobicContact CE1-CD 3.71Å; Y52-K83 HydrophobicContact CE1-CG 4.02Å; Y52-K83 HydrophobicContact CE2-CD 4.4Å; Y52-K83 PolarHBondContact O-NZ 3.07Å; R79-K83 VanDerWaalsContact O-CB 3.31Å; R79-K83 WeakPolarHBondContact O-CB 3.21Å; R79-K83 PolarHBondContact O-N 3.01Å; L80-K83 PolarHBondContact O-N 2.86Å; K83-S87 WeakPolarHBondContact O-CA 3.38Å; K83-S87 WeakPolarHBondContact O-CB 3.32Å; K83-S87 PolarHBondContact O-N 3.49Å; K83-S87 PolarHBondContact O-OG 3.21Å
84	L	94.1	Very high	86.4	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-66.2	-45.4	177.4	-69.9	176.1	0	0	0	112	Y52 L80 A81 Y82 I88 L89 W207 V240 A244 L249	Y52-L84 HydrophobicContact CE1-CD2 3.85Å; Y52-L84 HydrophobicContact CE1-CG 4.23Å; L80-L84 HydrophobicContact CD1-CD1 3.77Å; L80-L84 HydrophobicContact CD1-CG 4.12Å; L80-L84 HydrophobicContact CG-CD1 3.84Å; L80-L84 HydrophobicContact CG-CG 4.46Å; L80-L84 WeakPolarHBondContact O-CB 3.48Å; L80-L84 VanDerWaalsContact O-CG 3.26Å; L80-L84 WeakPolarHBondContact O-CG 3.34Å; L80-L84 PolarHBondContact O-N 2.77Å; A81-L84 PolarHBondContact O-N 2.67Å; Y82-L84 PolarHBondContact O-N 3.39Å; L84-I88 HydrophobicContact CD2-CG1 4.44Å; L84-I88 WeakPolarHBondContact O-CA 3.19Å; L84-I88 WeakPolarHBondContact O-CB 3.27Å; L84-I88 PolarHBondContact O-N 2.96Å; L84-I88 VanDerWaalsContact O-N 3.11Å; L84-L89 WeakPolarHBondContact O-CG 3.27Å; L84-L89 PolarHBondContact O-N 3.19Å; L84-W207 HydrophobicContact CB-CH2 4.22Å; L84-W207 HydrophobicContact CD1-CH2 4.46Å; L84-V240 HydrophobicContact CD1-CG1 3.44Å; L84-V240 VanDerWaalsContact CD1-CG1 3.44Å; L84-A244 HydrophobicContact CD2-CB 3.83Å; L84-L249 HydrophobicContact CD2-CD2 3.84Å
85	H	93.1	Very high	84.4	Confident	13 Å²	13	44.5 Å²	44.5	6%	0.06	22%	0.221	C	C	.	.	I	π-helix	trans	-62.4	-58.1	-177	-166.2	79.2	0	0	0	111.7	A81 Y82 L89 E90 P138 F140 W207	A81-H85 VanDerWaalsContact O-CB 3.26Å; A81-H85 WeakPolarHBondContact O-CB 3.41Å; A81-H85 PolarHBondContact O-N 2.64Å; Y82-H85 PolarHBondContact O-N 3.49Å; H85-L89 PolarHBondContact O-N 3.09Å; H85-E90 WeakPolarHBondContact O-CB 3.2Å; H85-E90 PolarHBondContact O-N 3.28Å; H85-P138 PolarHBondContact CE1-O 3.12Å; H85-P138 VanDerWaalsContact CE1-O 3.3Å; H85-F140 HydrophobicContact CB-CD2 3.64Å; H85-F140 HydrophobicContact CB-CE2 3.84Å; H85-F140 HydrophobicContact CB-CG 4.48Å; H85-F140 AromaticContact CD2-CD2 3.72Å; H85-F140 AromaticContact CD2-CG 3.89Å; H85-F140 AromaticContact CG-CD2 3.51Å; H85-F140 AromaticContact ND1-CD2 3.98Å; H85-W207 HydrophobicContact CB-CZ2 4.02Å; H85-W207 AromaticContact ND1-NE1 3.64Å
86	Y	91	Very high	81.9	Confident	90 Å²	90	47.1 Å²	47.1	35%	0.353	24%	0.244	S	C	.	.	I	π-helix	trans	-78.4	-31.5	-174	-68	-70.6	0	0	0	114.1	Y82 E90 F140	Y82-Y86 AromaticContact CD2-CD2 3.49Å; Y82-Y86 HydrophobicContact CD2-CD2 3.49Å; Y82-Y86 VanDerWaalsContact CD2-CD2 3.49Å; Y82-Y86 AromaticContact CD2-CE2 3.47Å; Y82-Y86 HydrophobicContact CD2-CE2 3.47Å; Y82-Y86 VanDerWaalsContact CD2-CE2 3.47Å; Y82-Y86 HydrophobicContact CE1-CD2 4.48Å; Y82-Y86 AromaticContact CE2-CD2 3.38Å; Y82-Y86 HydrophobicContact CE2-CD2 3.38Å; Y82-Y86 AromaticContact CE2-CE2 3.35Å; Y82-Y86 HydrophobicContact CE2-CE2 3.35Å; Y82-Y86 HydrophobicContact CE2-CG 4.44Å; Y82-Y86 HydrophobicContact CG-CD2 4.08Å; Y82-Y86 HydrophobicContact CG-CE2 4.44Å; Y82-Y86 AromaticContact CZ-CD2 3.91Å; Y82-Y86 WeakPolarHBondContact O-CD2 3.11Å; Y82-Y86 PolarHBondContact O-N 3.2Å; Y82-Y86 VanDerWaalsContact O-N 3.15Å; Y86-E90 WeakPolarHBondContact CD1-OE2 3.22Å; Y86-F140 HydrophobicContact CE2-CB 4.4Å; Y86-F140 AromaticContact CE2-CD1 3.69Å; Y86-F140 HydrophobicContact CE2-CD1 3.69Å; Y86-F140 HydrophobicContact CE2-CE1 4.17Å; Y86-F140 AromaticContact CE2-CG 4Å; Y86-F140 HydrophobicContact CE2-CG 4Å
87	S	88.2	Confident	79.1	Confident	69 Å²	69	52.2 Å²	52.2	48%	0.483	28%	0.277	S	S	.	.	I	π-helix	trans	-97.3	-10.2	-176.6	-45.8	0	0	0	0	115	K83 S91	K83-S87 WeakPolarHBondContact O-CA 3.38Å; K83-S87 WeakPolarHBondContact O-CB 3.32Å; K83-S87 PolarHBondContact O-N 3.49Å; K83-S87 PolarHBondContact O-OG 3.21Å; S87-S91 PolarHBondContact O-OG 3.09Å; S87-S91 VanDerWaalsContact O-OG 3.05Å
88	I	87.9	Confident	76.1	Confident	26 Å²	26	60.2 Å²	60.2	13%	0.133	31%	0.312	C	S	.	.	I	π-helix	trans	-132.4	-57.8	-178.1	-56.1	-68.8	0	0	0	111.9	L84 S91 G92 L249	L84-I88 HydrophobicContact CD2-CG1 4.44Å; L84-I88 WeakPolarHBondContact O-CA 3.19Å; L84-I88 WeakPolarHBondContact O-CB 3.27Å; L84-I88 PolarHBondContact O-N 2.96Å; L84-I88 VanDerWaalsContact O-N 3.11Å; I88-S91 WeakPolarHBondContact CA-OG 3.4Å; I88-S91 PolarHBondContact N-OG 2.93Å; I88-S91 PolarHBondContact O-OG 3.2Å; I88-S91 VanDerWaalsContact O-OG 3.14Å; I88-G92 WeakPolarHBondContact O-CA 3.41Å; I88-G92 PolarHBondContact O-N 3.08Å; I88-L249 HydrophobicContact CD1-CB 4.37Å; I88-L249 HydrophobicContact CD1-CD1 4.06Å; I88-L249 HydrophobicContact CG1-CD1 4.31Å; I88-L249 HydrophobicContact CG2-CB 4.17Å
89	L	86.8	Confident	73.4	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	35%	0.35	C	S	.	.	I	π-helix	trans	-68.6	-50.3	-169.7	-57.7	-179.2	0	0	0	112	L84 H85 L137 W207 L211 Y247	L84-L89 WeakPolarHBondContact O-CG 3.27Å; L84-L89 PolarHBondContact O-N 3.19Å; H85-L89 PolarHBondContact O-N 3.09Å; L89-L137 HydrophobicContact CB-CD1 3.87Å; L89-L137 HydrophobicContact CB-CD2 4.07Å; L89-L137 HydrophobicContact CD1-CD2 4.3Å; L89-W207 HydrophobicContact CD1-CZ2 4.06Å; L89-L211 HydrophobicContact CD1-CD1 3.83Å; L89-L211 HydrophobicContact CD1-CD2 3.85Å; L89-Y247 HydrophobicContact CD2-CD2 3.32Å; L89-Y247 HydrophobicContact CD2-CE2 3.88Å; L89-Y247 HydrophobicContact CD2-CG 3.73Å
90	E	84.3	Confident	70.8	Confident	106 Å²	106	73.9 Å²	73.9	50%	0.495	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-41.3	178.8	-171.3	175.7	-167.2	0	0	111.7	H85 Y86 G92	H85-E90 WeakPolarHBondContact O-CB 3.2Å; H85-E90 PolarHBondContact O-N 3.28Å; Y86-E90 WeakPolarHBondContact CD1-OE2 3.22Å; E90-G92 PolarHBondContact O-N 3.3Å
91	S	78.6	Confident	67.8	Low	60 Å²	60	78.3 Å²	78.3	42%	0.42	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-74.3	-18.7	-179.9	55.6	0	0	0	0	115.1	S87 I88 H93 Q94	S87-S91 PolarHBondContact O-OG 3.09Å; S87-S91 VanDerWaalsContact O-OG 3.05Å; I88-S91 WeakPolarHBondContact CA-OG 3.4Å; I88-S91 PolarHBondContact N-OG 2.93Å; I88-S91 PolarHBondContact O-OG 3.2Å; I88-S91 VanDerWaalsContact O-OG 3.14Å; S91-H93 PolarHBondContact O-N 3.04Å; S91-Q94 PolarHBondContact O-N 3.13Å
92	G	63.6	Low	65.1	Low	11 Å²	11	86.7 Å²	86.7	11%	0.113	47%	0.467	C	S	.	.	G	3₁₀ helix	trans	-59.6	-15.6	-171	0	0	0	0	0	115.1	I88 E90 Q94 I95	I88-G92 WeakPolarHBondContact O-CA 3.41Å; I88-G92 PolarHBondContact O-N 3.08Å; E90-G92 PolarHBondContact O-N 3.3Å; G92-Q94 PolarHBondContact O-N 3.25Å; G92-I95 PolarHBondContact O-N 3.07Å; G92-I95 VanDerWaalsContact O-N 3.15Å
93	H	53.8	Low	62.4	Low	113 Å²	113	89.4 Å²	89.4	52%	0.523	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-53.9	-23.8	177.6	-130.6	125.2	0	0	0	114.6	S91 P134	S91-H93 PolarHBondContact O-N 3.04Å; H93-P134 HydrophobicContact CB-CG 4.22Å; H93-P134 WeakPolarHBondContact ND1-CG 3.41Å
94	Q	49.7	Very low	59.5	Low	155 Å²	155	96.7 Å²	96.7	72%	0.724	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-92	-6	-177.5	-63.5	-135.8	78.3	0	0	115.3	S91 G92	S91-Q94 PolarHBondContact O-N 3.13Å; G92-Q94 PolarHBondContact O-N 3.25Å
95	I	50.1	Low	56.8	Low	121 Å²	121	102.1 Å²	102.1	62%	0.621	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-14.7	-177.5	-60.6	177.8	0	0	0	112	G92	G92-I95 PolarHBondContact O-N 3.07Å; G92-I95 VanDerWaalsContact O-N 3.15Å
96	A	38.9	Very low	53.9	Low	64 Å²	64	106.9 Å²	106.9	53%	0.529	59%	0.594	S	S	.	*	S	Bend	trans	-61.6	129.2	168	0	0	0	0	0	110.5	K98	A96-K98 PolarHBondContact O-N 2.78Å; A96-K98 VanDerWaalsContact O-N 3.12Å
97	P	35.8	Very low	51.1	Low	108 Å²	108	110.6 Å²	110.6	70%	0.701	61%	0.614	S	S	*	*			trans	-66.4	116.5	-179.1	26.5	-33.3	0	0	0	109.9	S99	P97-S99 VanDerWaalsContact C-N 3.33Å; P97-S99 PolarHBondContact O-N 3.48Å
98	K	32	Very low	48.4	Very low	169 Å²	169	114 Å²	114	74%	0.735	63%	0.627	S	S	*	*			trans	-63.6	91.7	175	-68.1	178.8	-178.1	173.9	0	109.7	A96 K100	A96-K98 PolarHBondContact O-N 2.78Å; A96-K98 VanDerWaalsContact O-N 3.12Å; K98-K100 PolarHBondContact O-N 3.11Å; K98-K100 VanDerWaalsContact O-N 3.11Å
99	S	38.6	Very low	45.6	Very low	116 Å²	116	118 Å²	118	81%	0.811	66%	0.658	S	S	*	*			trans	-57.5	114.4	166.2	44.7	0	0	0	0	107.8	P97 A101	P97-S99 VanDerWaalsContact C-N 3.33Å; P97-S99 PolarHBondContact O-N 3.48Å; S99-A101 PolarHBondContact O-N 2.83Å
100	K	38.6	Very low	43	Very low	204 Å²	204	124.6 Å²	124.6	89%	0.887	69%	0.693	S	S	*	*			trans	-67.4	109.3	-177.7	-69.8	179.6	-179.7	176.2	0	108.7	K98	K98-K100 PolarHBondContact O-N 3.11Å; K98-K100 VanDerWaalsContact O-N 3.11Å
101	A	34.8	Very low	40.6	Very low	93 Å²	93	126.3 Å²	126.3	77%	0.769	71%	0.705	S	S	*	*			trans	-57.8	157.1	159	0	0	0	0	0	109.8	S99	S99-A101 PolarHBondContact O-N 2.83Å
102	L	38.6	Very low	38.5	Very low	176 Å²	176	130.8 Å²	130.8	92%	0.921	73%	0.725	S	S	*	*			trans	77.3	71.1	171.2	-155.3	76.8	0	0	0	117.9
103	S	38.3	Very low	37.1	Very low	114 Å²	114	137.7 Å²	137.7	80%	0.797	76%	0.759	S	S	*	*			trans	-155.2	115.7	133.8	60.5	0	0	0	0	111.2	S105	S103-S105 PolarHBondContact O-N 3.03Å
104	K	33.9	Very low	36.2	Very low	220 Å²	220	134.6 Å²	134.6	96%	0.957	76%	0.758	S	S	*	*			trans	-78.9	110.6	167.7	-72.3	-179.4	178.2	178.8	0	108.8
105	S	36	Very low	35.8	Very low	115 Å²	115	137 Å²	137	80%	0.804	76%	0.761	S	S	*	*			trans	-152.3	156.9	160.9	-164.4	0	0	0	0	109.7	S103	S103-S105 PolarHBondContact O-N 3.03Å
106	T	32.9	Very low	35.4	Very low	113 Å²	113	134.9 Å²	134.9	69%	0.693	76%	0.756	S	S	*	*			trans	-99.6	152.2	-165.6	-33.6	0	0	0	0	112.2
107	H	32.6	Very low	35.9	Very low	167 Å²	167	134.5 Å²	134.5	77%	0.773	74%	0.741	S	S	*	*			trans	73.9	153	169.1	-68.4	-76.9	0	0	0	119.6
108	N	30.7	Very low	36.6	Very low	140 Å²	140	133.5 Å²	133.5	75%	0.749	73%	0.727	S	S	*	*			trans	72.2	116.8	167.1	-66.8	-6.7	0	0	0	120	N110	N108-N110 PolarHBondContact O-ND2 3.31Å
109	S	29.6	Very low	37.7	Very low	111 Å²	111	131.9 Å²	131.9	78%	0.776	72%	0.72	S	S	*	*			trans	29.1	109.4	142	-160.2	0	0	0	0	118
110	N	32.6	Very low	38.6	Very low	141 Å²	141	126.6 Å²	126.6	75%	0.754	68%	0.683	S	S	*	*			trans	-138	113	166.5	-90.4	-80	0	0	0	111.3	N108 N112	N108-N110 PolarHBondContact O-ND2 3.31Å; N110-N112 PolarHBondContact O-N 2.97Å
111	N	33.6	Very low	39.2	Very low	141 Å²	141	124.5 Å²	124.5	75%	0.754	67%	0.67	S	S	*	*			trans	-68.7	95.9	171.8	-70.8	-17.4	0	0	0	109.7	N113	N111-N113 PolarHBondContact O-N 3.17Å
112	N	34.4	Very low	39.8	Very low	154 Å²	154	120.6 Å²	120.6	82%	0.824	64%	0.639	S	S	*	*			trans	-73.7	78	174.5	-83.1	-28.5	0	0	0	110.9	N110 G114	N110-N112 PolarHBondContact O-N 2.97Å; N112-G114 PolarHBondContact O-N 3.37Å
113	N	34.1	Very low	40.5	Very low	156 Å²	156	112.9 Å²	112.9	83%	0.834	60%	0.6	S	S	*	*			trans	-68.9	52	168.9	-83.6	-19.2	0	0	0	112.1	N111 R115	N111-N113 PolarHBondContact O-N 3.17Å; N113-R115 PolarHBondContact O-N 3.1Å
114	G	34.7	Very low	41.1	Very low	49 Å²	49	110.4 Å²	110.4	51%	0.505	58%	0.58	S	S	.	*			trans	-72.7	121	166.4	0	0	0	0	0	109.3	N112 S116	N112-G114 PolarHBondContact O-N 3.37Å; G114-S116 PolarHBondContact O-N 3.44Å
115	R	41.3	Very low	41.9	Very low	206 Å²	206	101 Å²	101	78%	0.777	54%	0.542	S	S	*	.			trans	-67.6	73.5	171.5	-76.8	177.5	164.1	161.3	-6	110.8	N113 Y117	N113-R115 PolarHBondContact O-N 3.1Å; R115-Y117 HydrophobicContact CB-CD2 4.41Å; R115-Y117 HydrophobicContact CB-CE2 3.85Å; R115-Y117 HydrophobicContact CG-CE2 4.4Å; R115-Y117 PolarHBondContact O-N 3.37Å
116	S	41.6	Very low	42.5	Very low	75 Å²	75	99.5 Å²	99.5	52%	0.524	53%	0.525	S	S	.	.			trans	-78.9	98.8	172.8	-174.1	0	0	0	0	110.4	G114 E118	G114-S116 PolarHBondContact O-N 3.44Å; S116-E118 PolarHBondContact O-N 3.25Å; S116-E118 WeakPolarHBondContact OG-CB 3.29Å; S116-E118 VanDerWaalsContact OG-CD 3.31Å; S116-E118 WeakPolarHBondContact OG-CG 3.45Å; S116-E118 PolarHBondContact OG-N 2.91Å; S116-E118 PolarHBondContact OG-OE2 3.44Å
117	Y	50.4	Low	43.4	Very low	56 Å²	56	104 Å²	104	22%	0.22	53%	0.529	C	S	.	.			trans	-81.2	22.6	170.3	-63.3	-61.2	0	0	0	112.8	R115 F119 R246 R260 E264	R115-Y117 HydrophobicContact CB-CD2 4.41Å; R115-Y117 HydrophobicContact CB-CE2 3.85Å; R115-Y117 HydrophobicContact CG-CE2 4.4Å; R115-Y117 PolarHBondContact O-N 3.37Å; Y117-F119 PolarHBondContact O-N 3.38Å; Y117-F119 VanDerWaalsContact O-N 3.12Å; Y117-R246 PolarHBondContact O-NE 3.09Å; Y117-R260 HydrophobicContact CD1-CG 3.88Å; Y117-R260 HydrophobicContact CE1-CG 3.63Å; Y117-E264 HydrophobicContact CE1-CG 4.27Å; Y117-E264 WeakPolarHBondContact CE1-OE1 3.39Å; Y117-E264 PolarHBondContact OH-OE1 2.93Å
118	E	50.3	Low	44.1	Very low	88 Å²	88	100.7 Å²	100.7	41%	0.411	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-30.4	-176.3	-86.2	175.5	88.9	0	0	114	S116 K130 R246	S116-E118 PolarHBondContact O-N 3.25Å; S116-E118 WeakPolarHBondContact OG-CB 3.29Å; S116-E118 VanDerWaalsContact OG-CD 3.31Å; S116-E118 WeakPolarHBondContact OG-CG 3.45Å; S116-E118 PolarHBondContact OG-N 2.91Å; S116-E118 PolarHBondContact OG-OE2 3.44Å; E118-K130 IonicContact OE1-NZ 3.23Å; E118-K130 PolarHBondContact OE1-NZ 2.68Å; E118-R246 PolarHBondContact O-NE 3.36Å; E118-R246 PolarHBondContact O-NH2 3.49Å
119	F	54.3	Low	45.1	Very low	134 Å²	134	94.6 Å²	94.6	59%	0.588	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.1	72.5	-174.5	-66	-74.8	0	0	0	112.9	Y117 R121 K130	Y117-F119 PolarHBondContact O-N 3.38Å; Y117-F119 VanDerWaalsContact O-N 3.12Å; F119-R121 PolarHBondContact O-N 3.48Å; F119-R121 VanDerWaalsContact O-N 3.17Å; F119-K130 VanDerWaalsContact CZ-CE 3.44Å
120	L	57.6	Low	46.2	Very low	6 Å²	6	94.7 Å²	94.7	3%	0.031	47%	0.471	C	S	.	.			trans	-55.4	119	153.9	-70.8	177.9	0	0	0	108.2	G122 A123 R242 V256 R260 D263	L120-G122 PolarHBondContact O-N 3.14Å; L120-A123 HydrophobicContact CB-CB 4.31Å; L120-A123 WeakPolarHBondContact O-CB 3.38Å; L120-A123 PolarHBondContact O-N 2.79Å; L120-A123 VanDerWaalsContact O-N 3.1Å; L120-R242 HydrophobicContact CD1-CB 4.02Å; L120-R242 HydrophobicContact CD1-CG 4.05Å; L120-V256 HydrophobicContact CD1-CG1 4.45Å; L120-R260 HydrophobicContact CD2-CB 3.76Å; L120-R260 HydrophobicContact CD2-CG 3.99Å; L120-D263 WeakPolarHBondContact CA-OD2 2.96Å
121	R	50.5	Low	47.3	Very low	160 Å²	160	93.3 Å²	93.3	60%	0.604	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	51.2	-156.3	-160.3	-175.7	-173.5	-152.5	7.9	113.3	F119 D263 E266 R538	F119-R121 PolarHBondContact O-N 3.48Å; F119-R121 VanDerWaalsContact O-N 3.17Å; R121-D263 VanDerWaalsContact CB-OD1 3.25Å; R121-D263 WeakPolarHBondContact CB-OD1 3.33Å; R121-D263 PolarHBondContact N-OD2 3.26Å; R121-E266 WeakPolarHBondContact CD-OE2 3.38Å; R121-E266 IonicContact CZ-OE2 3.34Å; R121-E266 VanDerWaalsContact CZ-OE2 3.26Å; R121-E266 IonicContact NE-OE2 2.69Å; R121-E266 PolarHBondContact NE-OE2 3Å; R121-E266 IonicContact NH1-OE1 3.7Å; R121-E266 PolarHBondContact NH1-OE1 2.73Å; R121-E266 IonicContact NH1-OE2 2.71Å; R121-E266 PolarHBondContact NH1-OE2 3.36Å; R121-R538 PolarHBondContact O-NH2 2.97Å
122	G	49.1	Very low	48.8	Very low	11 Å²	11	87.8 Å²	87.8	11%	0.113	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	170.7	-10.2	-167.4	0	0	0	0	0	113.8	L120 V124 R242 G540 G541	L120-G122 PolarHBondContact O-N 3.14Å; G122-V124 PolarHBondContact O-N 3.19Å; G122-R242 PolarHBondContact O-NH1 2.93Å; G122-G540 WeakPolarHBondContact CA-O 3.24Å; G122-G541 CarbonylContact O-C 3.59Å; G122-G541 WeakPolarHBondContact O-CA 3.35Å
123	A	52.1	Low	50.2	Low	14 Å²	14	83.6 Å²	83.6	12%	0.116	41%	0.414	C	S	.	.			trans	-53.8	120.1	159.4	0	0	0	0	0	108.7	L120 S125 E239 R242	L120-A123 HydrophobicContact CB-CB 4.31Å; L120-A123 WeakPolarHBondContact O-CB 3.38Å; L120-A123 PolarHBondContact O-N 2.79Å; L120-A123 VanDerWaalsContact O-N 3.1Å; A123-S125 VanDerWaalsContact CB-OG 3.31Å; A123-S125 WeakPolarHBondContact CB-OG 3.46Å; A123-S125 PolarHBondContact O-N 2.91Å; A123-S125 PolarHBondContact O-OG 3.11Å; A123-E239 VanDerWaalsContact C-OE1 3.27Å; A123-E239 VanDerWaalsContact CA-OE1 3.29Å; A123-E239 WeakPolarHBondContact CA-OE1 3.38Å; A123-E239 WeakPolarHBondContact CA-OE2 3.47Å; A123-E239 WeakPolarHBondContact CB-OE1 3.48Å; A123-R242 HydrophobicContact CB-CB 4.41Å
124	V	51.7	Low	51.6	Low	62 Å²	62	77.7 Å²	77.7	38%	0.376	38%	0.384	S	S	.	.			trans	-68.9	-13.4	178.2	-159.3	0	0	0	0	110.3	G122 N126 P214 I217 E239	G122-V124 PolarHBondContact O-N 3.19Å; V124-N126 PolarHBondContact O-N 3.09Å; V124-P214 HydrophobicContact CB-CG 4Å; V124-P214 HydrophobicContact CG1-CB 4.29Å; V124-P214 HydrophobicContact CG1-CG 3.91Å; V124-P214 WeakPolarHBondContact O-CG 3.13Å; V124-I217 HydrophobicContact CB-CD1 4.19Å; V124-I217 HydrophobicContact CG2-CD1 4.01Å; V124-I217 HydrophobicContact CG2-CG2 4.23Å; V124-E239 VanDerWaalsContact N-CD 3.28Å; V124-E239 PolarHBondContact N-OE1 3.12Å; V124-E239 PolarHBondContact N-OE2 3.25Å; V124-E239 VanDerWaalsContact N-OE2 3.09Å
125	S	50.7	Low	53.2	Low	22 Å²	22	82.5 Å²	82.5	15%	0.154	40%	0.397	C	S	.	.			trans	-19.1	110.7	166.8	63.2	0	0	0	0	113.7	A123 L129 E239 R246	A123-S125 VanDerWaalsContact CB-OG 3.31Å; A123-S125 WeakPolarHBondContact CB-OG 3.46Å; A123-S125 PolarHBondContact O-N 2.91Å; A123-S125 PolarHBondContact O-OG 3.11Å; S125-L129 VanDerWaalsContact CB-CD1 3.47Å; S125-E239 PolarHBondContact N-OE1 3.29Å; S125-R246 PolarHBondContact OG-NH2 3.11Å
126	N	48.7	Very low	54.9	Low	83 Å²	83	75.3 Å²	75.3	44%	0.444	38%	0.378	S	S	.	.			trans	-54.3	151.4	170.8	-175.6	3.1	0	0	0	110	V124 D128 L129	V124-N126 PolarHBondContact O-N 3.09Å; N126-D128 PolarHBondContact ND2-OD2 2.93Å; N126-D128 PolarHBondContact O-N 3Å; N126-D128 VanDerWaalsContact O-N 3.08Å; N126-L129 WeakPolarHBondContact O-CB 3.39Å; N126-L129 PolarHBondContact O-N 2.82Å
127	R	50.3	Low	56.8	Low	207 Å²	207	73.1 Å²	73.1	78%	0.781	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-56.2	-27.7	176.3	-68.5	-179.3	175.5	-177.1	-1.5	112.1	L129 K130	R127-L129 PolarHBondContact O-N 2.75Å; R127-K130 WeakPolarHBondContact O-CB 3.33Å; R127-K130 WeakPolarHBondContact O-CG 3.48Å; R127-K130 PolarHBondContact O-N 2.77Å; R127-K130 VanDerWaalsContact O-N 3.11Å
128	D	47.1	Very low	58.4	Low	99 Å²	99	71.6 Å²	71.6	53%	0.529	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-62.2	-18.6	176.9	-56.5	-25.3	0	0	0	113.7	N126 K130 N131	N126-D128 PolarHBondContact ND2-OD2 2.93Å; N126-D128 PolarHBondContact O-N 3Å; N126-D128 VanDerWaalsContact O-N 3.08Å; D128-K130 PolarHBondContact O-N 2.86Å; D128-K130 VanDerWaalsContact O-N 3.1Å; D128-N131 WeakPolarHBondContact O-CB 3.35Å; D128-N131 PolarHBondContact O-N 2.92Å
129	L	53.1	Low	60.2	Low	11 Å²	11	72.9 Å²	72.9	6%	0.058	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-63.4	-11.4	171.5	-105.5	142.6	0	0	0	113.3	S125 N126 R127 N131 L132 G212 I243	S125-L129 VanDerWaalsContact CB-CD1 3.47Å; N126-L129 WeakPolarHBondContact O-CB 3.39Å; N126-L129 PolarHBondContact O-N 2.82Å; R127-L129 PolarHBondContact O-N 2.75Å; L129-N131 PolarHBondContact O-N 2.69Å; L129-L132 HydrophobicContact CD2-CD1 3.5Å; L129-L132 HydrophobicContact CG-CD1 3.82Å; L129-G212 WeakPolarHBondContact CD1-O 3.22Å; L129-I243 HydrophobicContact CD1-CD1 4.13Å; L129-I243 HydrophobicContact CD1-CG1 4.32Å; L129-I243 HydrophobicContact CD2-CD1 4.3Å; L129-I243 HydrophobicContact CD2-CG1 4.06Å; L129-I243 HydrophobicContact CD2-CG2 4.16Å
130	K	52.4	Low	62	Low	113 Å²	113	67.7 Å²	67.7	49%	0.491	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-62.1	-23.2	165.3	-78	176.9	166.5	-80.4	0	113.5	E118 F119 R127 D128	E118-K130 IonicContact OE1-NZ 3.23Å; E118-K130 PolarHBondContact OE1-NZ 2.68Å; F119-K130 VanDerWaalsContact CZ-CE 3.44Å; R127-K130 WeakPolarHBondContact O-CB 3.33Å; R127-K130 WeakPolarHBondContact O-CG 3.48Å; R127-K130 PolarHBondContact O-N 2.77Å; R127-K130 VanDerWaalsContact O-N 3.11Å; D128-K130 PolarHBondContact O-N 2.86Å; D128-K130 VanDerWaalsContact O-N 3.1Å
131	N	55.5	Low	63.7	Low	112 Å²	112	68.8 Å²	68.8	60%	0.599	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-92.7	-5.3	-173.8	-57.4	-26.7	0	0	0	113.3	D128 L129 T133 S136	D128-N131 WeakPolarHBondContact O-CB 3.35Å; D128-N131 PolarHBondContact O-N 2.92Å; L129-N131 PolarHBondContact O-N 2.69Å; N131-T133 VanDerWaalsContact C-N 3.35Å; N131-T133 PolarHBondContact O-N 2.95Å; N131-S136 PolarHBondContact O-OG 3.45Å
132	L	63.8	Low	65.7	Low	26 Å²	26	65 Å²	65	14%	0.136	36%	0.359	C	S	.	.			trans	-79.8	80.6	179.8	-83.8	161.8	0	0	0	111.3	L129 S136 L137 L211 Y247	L129-L132 HydrophobicContact CD2-CD1 3.5Å; L129-L132 HydrophobicContact CG-CD1 3.82Å; L132-S136 WeakPolarHBondContact CD2-O 3.44Å; L132-L137 HydrophobicContact CD2-CD2 4.45Å; L132-L211 VanDerWaalsContact CD1-O 3.31Å; L132-L211 WeakPolarHBondContact CD1-O 3.37Å; L132-Y247 VanDerWaalsContact CB-OH 3.24Å; L132-Y247 WeakPolarHBondContact CB-OH 3.41Å; L132-Y247 PolarHBondContact O-OH 3.26Å
133	T	64.6	Low	67.8	Low	65 Å²	65	67.5 Å²	67.5	40%	0.399	37%	0.372	S	S	.	.			trans	-77.7	161.9	161.5	71	0	0	0	0	109.9	N131 I135 S136 L137	N131-T133 VanDerWaalsContact C-N 3.35Å; N131-T133 PolarHBondContact O-N 2.95Å; T133-I135 PolarHBondContact O-N 2.81Å; T133-I135 VanDerWaalsContact O-N 3.09Å; T133-I135 PolarHBondContact OG1-N 3.08Å; T133-S136 PolarHBondContact N-OG 3.08Å; T133-S136 CarbonylContact O-C 3.58Å; T133-S136 PolarHBondContact O-N 3.14Å; T133-S136 PolarHBondContact O-OG 3.47Å; T133-S136 PolarHBondContact OG1-N 3.49Å; T133-S136 PolarHBondContact OG1-OG 3.49Å; T133-L137 PolarHBondContact O-N 2.68Å
134	P	64.3	Low	69.8	Low	33 Å²	33	66.9 Å²	66.9	21%	0.214	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-16	171.3	-25.7	36.7	0	0	0	114.7	H93 L137	H93-P134 HydrophobicContact CB-CG 4.22Å; H93-P134 WeakPolarHBondContact ND1-CG 3.41Å; P134-L137 HydrophobicContact CB-CD1 4.19Å
135	I	68.2	Low	71.8	Confident	150 Å²	150	64.9 Å²	64.9	77%	0.769	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-25.5	173.8	-58.3	170.6	0	0	0	111.2	T133	T133-I135 PolarHBondContact O-N 2.81Å; T133-I135 VanDerWaalsContact O-N 3.09Å; T133-I135 PolarHBondContact OG1-N 3.08Å
136	S	76.8	Confident	73.8	Confident	55 Å²	55	68.2 Å²	68.2	39%	0.385	37%	0.371	S	S	.	.	S	Bend	trans	-107.5	16.4	-179.8	51.5	0	0	0	0	113.3	N131 L132 T133	N131-S136 PolarHBondContact O-OG 3.45Å; L132-S136 WeakPolarHBondContact CD2-O 3.44Å; T133-S136 PolarHBondContact N-OG 3.08Å; T133-S136 CarbonylContact O-C 3.58Å; T133-S136 PolarHBondContact O-N 3.14Å; T133-S136 PolarHBondContact O-OG 3.47Å; T133-S136 PolarHBondContact OG1-N 3.49Å; T133-S136 PolarHBondContact OG1-OG 3.49Å
137	L	82.1	Confident	75.9	Confident	28 Å²	28	64.5 Å²	64.5	15%	0.147	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-65.4	141.6	169.7	-78.2	169.4	0	0	0	110.5	L89 L132 T133 P134 L211	L89-L137 HydrophobicContact CB-CD1 3.87Å; L89-L137 HydrophobicContact CB-CD2 4.07Å; L89-L137 HydrophobicContact CD1-CD2 4.3Å; L132-L137 HydrophobicContact CD2-CD2 4.45Å; T133-L137 PolarHBondContact O-N 2.68Å; P134-L137 HydrophobicContact CB-CD1 4.19Å; L137-L211 HydrophobicContact CD2-CD2 3.86Å
138	P	83	Confident	77.8	Confident	24 Å²	24	54.6 Å²	54.6	16%	0.156	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-67.6	145.5	174.8	30.2	-36.1	0	0	0	110.8	H85 F140 D210 L211	H85-P138 PolarHBondContact CE1-O 3.12Å; H85-P138 VanDerWaalsContact CE1-O 3.3Å; P138-F140 PolarHBondContact O-N 2.79Å; P138-D210 HydrophobicContact CB-CB 3.68Å; P138-D210 HydrophobicContact CG-CB 3.86Å; P138-L211 HydrophobicContact CG-CD2 3.97Å; P138-L211 HydrophobicContact CG-CG 4.36Å
139	S	87.7	Confident	79.9	Confident	115 Å²	115	55.1 Å²	55.1	80%	0.804	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-61.7	128.9	177	48.8	0	0	0	0	111.2
140	F	92.7	Very high	81.5	Confident	26 Å²	26	58.8 Å²	58.8	11%	0.114	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-68.4	130.4	-174.7	-163.7	-104.2	0	0	0	112	A81 Y82 H85 Y86 P138 S142 L144 T145 W207	A81-F140 HydrophobicContact CB-CE2 3.88Å; A81-F140 HydrophobicContact CB-CZ 3.95Å; Y82-F140 AromaticContact CD2-CE1 3.95Å; Y82-F140 HydrophobicContact CD2-CE1 3.95Å; H85-F140 HydrophobicContact CB-CD2 3.64Å; H85-F140 HydrophobicContact CB-CE2 3.84Å; H85-F140 HydrophobicContact CB-CG 4.48Å; H85-F140 AromaticContact CD2-CD2 3.72Å; H85-F140 AromaticContact CD2-CG 3.89Å; H85-F140 AromaticContact CG-CD2 3.51Å; H85-F140 AromaticContact ND1-CD2 3.98Å; Y86-F140 HydrophobicContact CE2-CB 4.4Å; Y86-F140 AromaticContact CE2-CD1 3.69Å; Y86-F140 HydrophobicContact CE2-CD1 3.69Å; Y86-F140 HydrophobicContact CE2-CE1 4.17Å; Y86-F140 AromaticContact CE2-CG 4Å; Y86-F140 HydrophobicContact CE2-CG 4Å; P138-F140 PolarHBondContact O-N 2.79Å; F140-S142 PolarHBondContact O-N 3.03Å; F140-L144 HydrophobicContact CE1-CB 3.72Å; F140-L144 HydrophobicContact CE2-CD1 4.29Å; F140-L144 HydrophobicContact CZ-CB 3.64Å; F140-L144 HydrophobicContact CZ-CD1 4.06Å; F140-T145 WeakPolarHBondContact CD1-OG1 3.39Å; F140-T145 WeakPolarHBondContact CE1-OG1 3.48Å; F140-W207 AromaticContact CD2-CD1 3.82Å; F140-W207 AromaticContact CD2-NE1 3.43Å; F140-W207 HydrophobicContact CE2-CD2 4.4Å; F140-W207 AromaticContact CE2-CE2 3.86Å; F140-W207 HydrophobicContact CE2-CG 4.45Å; F140-W207 HydrophobicContact CE2-CZ2 4.31Å; F140-W207 AromaticContact CE2-NE1 3.6Å
141	P	93	Very high	82.9	Confident	28 Å²	28	58.3 Å²	58.3	18%	0.182	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-61.9	132.5	179.6	-24.9	34	0	0	0	113.5	T143 L144 T145 A203 W207	P141-T143 VanDerWaalsContact C-N 3.3Å; P141-T143 PolarHBondContact O-N 3.18Å; P141-L144 HydrophobicContact CB-CB 4.31Å; P141-L144 HydrophobicContact CB-CD1 4.16Å; P141-L144 HydrophobicContact CB-CG 4Å; P141-L144 HydrophobicContact CG-CD1 3.88Å; P141-L144 HydrophobicContact CG-CG 4.27Å; P141-L144 PolarHBondContact O-N 3.4Å; P141-T145 PolarHBondContact O-N 3.11Å; P141-T145 VanDerWaalsContact O-N 3.09Å; P141-T145 PolarHBondContact O-OG1 2.9Å; P141-A203 HydrophobicContact CB-CB 4.47Å; P141-W207 HydrophobicContact CG-CB 4.32Å
142	S	92.8	Very high	83.9	Confident	82 Å²	82	55 Å²	55	57%	0.573	32%	0.321	S	S	*	.	H	α-helix	trans	-60.4	-39.2	173	50	0	0	0	0	112.1	F140 L144 T145 D146	F140-S142 PolarHBondContact O-N 3.03Å; S142-L144 VanDerWaalsContact C-N 3.34Å; S142-L144 PolarHBondContact O-N 2.83Å; S142-T145 CarbonylContact O-C 3.51Å; S142-T145 WeakPolarHBondContact O-CA 2.87Å; S142-T145 VanDerWaalsContact O-CB 3.24Å; S142-T145 WeakPolarHBondContact O-CB 3.15Å; S142-T145 PolarHBondContact O-N 2.98Å; S142-D146 PolarHBondContact O-N 3.42Å
143	T	92.6	Very high	84.1	Confident	63 Å²	63	54.6 Å²	54.6	39%	0.387	32%	0.324	S	S	.	.	H	α-helix	trans	-57.1	-43.6	176.3	51	0	0	0	0	112.8	P141 T145 C147 A203	P141-T143 VanDerWaalsContact C-N 3.3Å; P141-T143 PolarHBondContact O-N 3.18Å; T143-T145 VanDerWaalsContact C-N 3.35Å; T143-C147 WeakPolarHBondContact O-CB 3.44Å; T143-C147 PolarHBondContact O-N 3.33Å; T143-A203 VanDerWaalsContact OG1-CB 3.3Å; T143-A203 WeakPolarHBondContact OG1-CB 3.35Å
144	L	94.7	Very high	84.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-68.3	-35.3	174.2	-62.4	-178.2	0	0	0	111.8	S78 A81 F140 P141 S142 A148 N200 A203 F204 W207	S78-L144 WeakPolarHBondContact OG-CD2 3.19Å; A81-L144 HydrophobicContact CB-CD1 4.05Å; F140-L144 HydrophobicContact CE1-CB 3.72Å; F140-L144 HydrophobicContact CE2-CD1 4.29Å; F140-L144 HydrophobicContact CZ-CB 3.64Å; F140-L144 HydrophobicContact CZ-CD1 4.06Å; P141-L144 HydrophobicContact CB-CB 4.31Å; P141-L144 HydrophobicContact CB-CD1 4.16Å; P141-L144 HydrophobicContact CB-CG 4Å; P141-L144 HydrophobicContact CG-CD1 3.88Å; P141-L144 HydrophobicContact CG-CG 4.27Å; P141-L144 PolarHBondContact O-N 3.4Å; S142-L144 VanDerWaalsContact C-N 3.34Å; S142-L144 PolarHBondContact O-N 2.83Å; L144-A148 WeakPolarHBondContact O-CB 3.14Å; L144-A148 PolarHBondContact O-N 3.43Å; L144-N200 WeakPolarHBondContact CD2-O 3.25Å; L144-A203 HydrophobicContact CD2-CB 3.89Å; L144-A203 HydrophobicContact CG-CB 3.93Å; L144-F204 HydrophobicContact CD2-CB 4.09Å; L144-W207 HydrophobicContact CD1-CB 3.99Å; L144-W207 HydrophobicContact CD1-CG 4.3Å
145	T	93.7	Very high	84.4	Confident	21 Å²	21	58.3 Å²	58.3	13%	0.129	35%	0.35	C	S	.	.	H	α-helix	trans	-63.1	-47	176.8	-56.2	0	0	0	0	111.5	Y82 F140 P141 S142 T143 K149	Y82-T145 HydrophobicContact CD2-CG2 4.45Å; Y82-T145 HydrophobicContact CE2-CG2 4.14Å; F140-T145 WeakPolarHBondContact CD1-OG1 3.39Å; F140-T145 WeakPolarHBondContact CE1-OG1 3.48Å; P141-T145 PolarHBondContact O-N 3.11Å; P141-T145 VanDerWaalsContact O-N 3.09Å; P141-T145 PolarHBondContact O-OG1 2.9Å; S142-T145 CarbonylContact O-C 3.51Å; S142-T145 WeakPolarHBondContact O-CA 2.87Å; S142-T145 VanDerWaalsContact O-CB 3.24Å; S142-T145 WeakPolarHBondContact O-CB 3.15Å; S142-T145 PolarHBondContact O-N 2.98Å; T143-T145 VanDerWaalsContact C-N 3.35Å; T145-K149 WeakPolarHBondContact O-CD 3.48Å; T145-K149 VanDerWaalsContact O-CG 3.3Å; T145-K149 WeakPolarHBondContact O-CG 3.45Å; T145-K149 PolarHBondContact O-N 3.47Å
146	D	92.5	Very high	84.5	Confident	91 Å²	91	51.7 Å²	51.7	49%	0.487	32%	0.317	S	S	.	.	H	α-helix	trans	-76.3	-36.4	-176.6	-63.7	-29.3	0	0	0	111.1	S142 K149	S142-D146 PolarHBondContact O-N 3.42Å; D146-K149 PolarHBondContact O-N 2.95Å; D146-K149 IonicContact OD1-NZ 2.68Å; D146-K149 PolarHBondContact OD1-NZ 2.76Å
147	C	92.3	Very high	84.1	Confident	5 Å²	5	51.3 Å²	51.3	3%	0.034	31%	0.31	C	S	.	.	H	α-helix	trans	-62.9	-45.7	170.4	-173.9	0	0	0	0	112	L75 S78 T143 K149 L150 N200	L75-C147 WeakPolarHBondContact CD1-O 3.34Å; S78-C147 PolarHBondContact OG-SG 3.49Å; S78-C147 VanDerWaalsContact OG-SG 3.39Å; T143-C147 WeakPolarHBondContact O-CB 3.44Å; T143-C147 PolarHBondContact O-N 3.33Å; C147-K149 PolarHBondContact O-N 3.45Å; C147-L150 VanDerWaalsContact O-CB 3.31Å; C147-L150 WeakPolarHBondContact O-CB 3.37Å; C147-L150 WeakPolarHBondContact O-CG 3.39Å; C147-L150 PolarHBondContact O-N 3.42Å; C147-N200 PolarHBondContact SG-ND2 2.92Å
148	A	92	Very high	83	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-58.2	-34.2	-179.3	0	0	0	0	0	113.5	R79 Y82 L144 L150	R79-A148 HydrophobicContact CG-CB 4.07Å; R79-A148 WeakPolarHBondContact CG-O 3.33Å; R79-A148 PolarHBondContact NE-O 3.47Å; R79-A148 VanDerWaalsContact NE-O 3.14Å; Y82-A148 HydrophobicContact CD1-CB 4.37Å; Y82-A148 HydrophobicContact CD2-CB 4.39Å; Y82-A148 HydrophobicContact CG-CB 3.89Å; L144-A148 WeakPolarHBondContact O-CB 3.14Å; L144-A148 PolarHBondContact O-N 3.43Å; A148-L150 VanDerWaalsContact C-N 3.33Å
149	K	89.4	Confident	81.6	Confident	110 Å²	110	53.7 Å²	53.7	48%	0.478	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-15	177.7	-67.6	165.8	-170.7	165.9	0	114.3	T145 D146 C147	T145-K149 WeakPolarHBondContact O-CD 3.48Å; T145-K149 VanDerWaalsContact O-CG 3.3Å; T145-K149 WeakPolarHBondContact O-CG 3.45Å; T145-K149 PolarHBondContact O-N 3.47Å; D146-K149 PolarHBondContact O-N 2.95Å; D146-K149 IonicContact OD1-NZ 2.68Å; D146-K149 PolarHBondContact OD1-NZ 2.76Å; C147-K149 PolarHBondContact O-N 3.45Å
150	L	86.8	Confident	79.7	Confident	87 Å²	87	54 Å²	54	46%	0.455	32%	0.316	S	S	.	.	S	Bend	trans	-61.5	144.2	179.3	-64.6	175.6	0	0	0	111	L75 R79 C147 A148	L75-L150 HydrophobicContact CD1-CB 4.11Å; R79-L150 PolarHBondContact NH2-O 2.9Å; C147-L150 VanDerWaalsContact O-CB 3.31Å; C147-L150 WeakPolarHBondContact O-CB 3.37Å; C147-L150 WeakPolarHBondContact O-CG 3.39Å; C147-L150 PolarHBondContact O-N 3.42Å; A148-L150 VanDerWaalsContact C-N 3.33Å
151	P	82.4	Confident	76.9	Confident	104 Å²	104	57.7 Å²	57.7	68%	0.675	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-64.7	153.2	173.6	29.3	-35.4	0	0	0	110.9	G153	P151-G153 PolarHBondContact O-N 2.92Å
152	L	76.1	Confident	74.4	Confident	41 Å²	41	62 Å²	62	22%	0.215	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-74.2	122.2	174.9	-67.3	169	0	0	0	109.8	F54 L75 D156 L157	F54-L152 HydrophobicContact CD1-CD1 3.77Å; F54-L152 HydrophobicContact CE1-CD1 3.64Å; F54-L152 HydrophobicContact CE1-CD2 3.8Å; F54-L152 HydrophobicContact CE1-CG 4.34Å; F54-L152 HydrophobicContact CZ-CD2 4.24Å; L75-L152 HydrophobicContact CD2-CD2 3.91Å; L75-L152 HydrophobicContact CG-CD2 4.47Å; L152-D156 HydrophobicContact CD2-CB 4.04Å; L152-L157 HydrophobicContact CB-CD1 3.87Å; L152-L157 HydrophobicContact CB-CG 4.02Å; L152-L157 HydrophobicContact CD1-CD1 4.48Å; L152-L157 HydrophobicContact CD1-CD2 3.95Å; L152-L157 HydrophobicContact CD1-CG 4.35Å
153	G	69.6	Low	71.4	Confident	19 Å²	19	65.7 Å²	65.7	20%	0.196	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-78.3	164.8	171.3	0	0	0	0	0	111.8	P151 S155 D156 L157	P151-G153 PolarHBondContact O-N 2.92Å; G153-S155 PolarHBondContact O-N 3.02Å; G153-D156 PolarHBondContact N-OD2 2.81Å; G153-D156 PolarHBondContact O-N 3.45Å; G153-L157 PolarHBondContact O-N 2.97Å
154	P	68	Low	68.5	Low	101 Å²	101	68.2 Å²	68.2	66%	0.656	40%	0.398	S	S	*	.	H	α-helix	trans	-55.5	-30	167.7	-24.8	34.9	0	0	0	112.6	D156 L157 C158	P154-D156 PolarHBondContact O-N 2.92Å; P154-L157 PolarHBondContact O-N 3.01Å; P154-C158 WeakPolarHBondContact O-CB 3.21Å; P154-C158 PolarHBondContact O-N 3.23Å
155	S	66.7	Low	65.8	Low	74 Å²	74	72.9 Å²	72.9	52%	0.517	43%	0.427	S	S	.	.	H	α-helix	trans	-55.9	-31.1	170.2	39.2	0	0	0	0	114.5	R70 G153	R70-S155 PolarHBondContact NH1-O 3.21Å; G153-S155 PolarHBondContact O-N 3.02Å
156	D	70.8	Confident	62.8	Low	11 Å²	11	77.5 Å²	77.5	6%	0.059	46%	0.461	C	S	.	.	H	α-helix	trans	-99.5	-10.4	-173	-52.8	-89.2	0	0	0	112	S73 L75 W76 L152 G153 P154	S73-D156 PolarHBondContact OG-OD1 3.4Å; L75-D156 HydrophobicContact CD2-CB 4.36Å; W76-D156 PolarHBondContact NE1-O 2.97Å; L152-D156 HydrophobicContact CD2-CB 4.04Å; G153-D156 PolarHBondContact N-OD2 2.81Å; G153-D156 PolarHBondContact O-N 3.45Å; P154-D156 PolarHBondContact O-N 2.92Å
157	L	67.7	Low	60.1	Low	47 Å²	47	82.6 Å²	82.6	25%	0.246	47%	0.474	C	S	.	.	H	α-helix	trans	-118.5	-48.1	-174.5	-73.6	172.5	0	0	0	114.5	A59 L152 G153 P154 S159	A59-L157 HydrophobicContact CB-CD2 3.69Å; L152-L157 HydrophobicContact CB-CD1 3.87Å; L152-L157 HydrophobicContact CB-CG 4.02Å; L152-L157 HydrophobicContact CD1-CD1 4.48Å; L152-L157 HydrophobicContact CD1-CD2 3.95Å; L152-L157 HydrophobicContact CD1-CG 4.35Å; G153-L157 PolarHBondContact O-N 2.97Å; P154-L157 PolarHBondContact O-N 3.01Å; L157-S159 PolarHBondContact O-N 3.49Å
158	C	58.3	Low	57.2	Low	73 Å²	73	92 Å²	92	49%	0.493	52%	0.515	S	S	.	.			trans	-79.8	117.7	-165.2	-63.2	0	0	0	0	111.7	R70 P154	R70-C158 PolarHBondContact NH1-O 3.16Å; R70-C158 PolarHBondContact NH2-O 3.03Å; P154-C158 WeakPolarHBondContact O-CB 3.21Å; P154-C158 PolarHBondContact O-N 3.23Å
159	S	53.9	Low	54.6	Low	29 Å²	29	100.7 Å²	100.7	20%	0.203	56%	0.555	C	S	.	*			trans	-70.8	139.7	164.4	-61.5	0	0	0	0	109.2	P61 I62 L157 S161	P61-S159 PolarHBondContact O-OG 3.04Å; I62-S159 WeakPolarHBondContact CG1-OG 3.38Å; L157-S159 PolarHBondContact O-N 3.49Å; S159-S161 VanDerWaalsContact C-N 3.34Å; S159-S161 PolarHBondContact O-N 3.26Å
160	F	48	Very low	52.1	Low	122 Å²	122	102.7 Å²	102.7	54%	0.535	57%	0.571	S	S	.	*			trans	-76	85.7	179.7	-78.8	-88.8	0	0	0	110.2	P162 I185	F160-P162 WeakPolarHBondContact O-CD 3.21Å; F160-I185 HydrophobicContact CD2-CD1 4.26Å; F160-I185 HydrophobicContact CE1-CD1 4.18Å; F160-I185 HydrophobicContact CE1-CG1 4.06Å; F160-I185 HydrophobicContact CE2-CD1 3.51Å; F160-I185 HydrophobicContact CE2-CG1 4.27Å; F160-I185 HydrophobicContact CZ-CD1 3.47Å; F160-I185 VanDerWaalsContact CZ-CD1 3.47Å; F160-I185 HydrophobicContact CZ-CG1 3.71Å; F160-I185 HydrophobicContact CZ-CG2 4.03Å
161	S	34.8	Very low	49.6	Very low	104 Å²	104	103.9 Å²	103.9	73%	0.727	59%	0.586	S	S	*	*			trans	-59.8	124.7	169.3	-175.6	0	0	0	0	109.3	S159 Q163	S159-S161 VanDerWaalsContact C-N 3.34Å; S159-S161 PolarHBondContact O-N 3.26Å; S161-Q163 PolarHBondContact O-N 2.84Å
162	P	38.4	Very low	47.6	Very low	117 Å²	117	106.8 Å²	106.8	76%	0.76	60%	0.596	S	S	*	*			trans	-66.9	109.6	174.8	26.8	-32.5	0	0	0	108.9	F160	F160-P162 WeakPolarHBondContact O-CD 3.21Å
163	Q	30.5	Very low	45.6	Very low	160 Å²	160	113.3 Å²	113.3	75%	0.748	63%	0.628	S	S	*	*			trans	-55	126.4	172.2	-82.4	-75.9	-2.9	0	0	109.4	S161 T165	S161-Q163 PolarHBondContact O-N 2.84Å; Q163-T165 VanDerWaalsContact C-N 3.28Å; Q163-T165 PolarHBondContact O-N 2.8Å
164	P	32.9	Very low	44.1	Very low	116 Å²	116	117.9 Å²	117.9	75%	0.753	66%	0.657	S	S	*	*			trans	-73.8	83.2	179.5	30.5	-34.8	0	0	0	110	S166	P164-S166 PolarHBondContact O-N 2.88Å
165	T	36.8	Very low	42.5	Very low	98 Å²	98	122.2 Å²	122.2	60%	0.601	67%	0.665	S	S	*	*			trans	-64	121.1	174.6	50.3	0	0	0	0	109.5	Q163 Y167	Q163-T165 VanDerWaalsContact C-N 3.28Å; Q163-T165 PolarHBondContact O-N 2.8Å; T165-Y167 HydrophobicContact CG2-CE2 4.38Å; T165-Y167 PolarHBondContact O-N 3.45Å; T165-Y167 WeakPolarHBondContact OG1-CD2 3.3Å
166	S	31.3	Very low	40.8	Very low	119 Å²	119	124.7 Å²	124.7	83%	0.832	68%	0.681	S	S	*	*			trans	-79.3	53.8	-166	55.5	0	0	0	0	114	P164 K168	P164-S166 PolarHBondContact O-N 2.88Å; S166-K168 PolarHBondContact O-N 3.1Å; S166-K168 VanDerWaalsContact O-N 3.11Å
167	Y	35.5	Very low	39.1	Very low	198 Å²	198	128.5 Å²	128.5	78%	0.776	70%	0.702	S	S	*	*			trans	-76.3	97.8	176	-69.1	-70.1	0	0	0	111.4	T165 H169	T165-Y167 HydrophobicContact CG2-CE2 4.38Å; T165-Y167 PolarHBondContact O-N 3.45Å; T165-Y167 WeakPolarHBondContact OG1-CD2 3.3Å; Y167-H169 PolarHBondContact O-N 3.38Å
168	K	31.2	Very low	37.9	Very low	203 Å²	203	133.3 Å²	133.3	88%	0.883	73%	0.726	S	S	*	*			trans	-59.8	114.7	160.8	-66.6	178.7	-179.8	178.1	0	108.5	S166	S166-K168 PolarHBondContact O-N 3.1Å; S166-K168 VanDerWaalsContact O-N 3.11Å
169	H	37.4	Very low	36.8	Very low	182 Å²	182	135.5 Å²	135.5	84%	0.843	73%	0.733	S	S	*	*			trans	-146.4	148.4	160.6	-120.4	-86.4	0	0	0	112.3	Y167	Y167-H169 PolarHBondContact O-N 3.38Å
170	N	36.2	Very low	35.9	Very low	152 Å²	152	140.9 Å²	140.9	81%	0.813	75%	0.753	S	S	*	*			trans	-72.9	152	-164.7	-67.4	-23.9	0	0	0	113.7	N172	N170-N172 PolarHBondContact O-N 3.43Å
171	S	34.2	Very low	35.4	Very low	112 Å²	112	140.2 Å²	140.2	78%	0.783	76%	0.761	S	S	*	*			trans	-62.3	115	170	53.1	0	0	0	0	112.3
172	N	40.4	Very low	35.5	Very low	164 Å²	164	142.8 Å²	142.8	88%	0.877	76%	0.759	S	S	*	*			trans	-160.9	159.2	143.8	-101.7	-31.1	0	0	0	110.6	N170	N170-N172 PolarHBondContact O-N 3.43Å
173	M	35.1	Very low	35.4	Very low	178 Å²	178	145.2 Å²	145.2	88%	0.877	76%	0.76	S	S	*	*			trans	-69.7	133.9	-165	-55.6	-179.8	76	0	0	113.9
174	S	37	Very low	35.5	Very low	116 Å²	116	144.7 Å²	144.7	81%	0.811	76%	0.762	S	S	*	*			trans	-172.8	119.3	137.9	-88.5	0	0	0	0	115.3
175	K	35.4	Very low	35.8	Very low	191 Å²	191	143.8 Å²	143.8	83%	0.83	75%	0.75	S	S	*	*			trans	35.9	90	140.3	-153.5	165.4	-168.4	169.2	0	117.9	N177	K175-N177 PolarHBondContact O-N 3.5Å; K175-N177 PolarHBondContact O-ND2 2.87Å
176	C	31.7	Very low	35.6	Very low	127 Å²	127	143.3 Å²	143.3	86%	0.858	75%	0.751	S	S	*	*			trans	-57.1	98.1	177.4	-51.2	0	0	0	0	113.3
177	N	34.7	Very low	36.1	Very low	91 Å²	91	143.4 Å²	143.4	49%	0.487	74%	0.741	S	S	.	*			trans	-86	114.5	153.5	-69.4	-104.2	0	0	0	106.3	K23 K175 D179	K23-N177 VanDerWaalsContact CE-OD1 3.29Å; K23-N177 WeakPolarHBondContact CE-OD1 3.31Å; K23-N177 PolarHBondContact NZ-OD1 2.79Å; K175-N177 PolarHBondContact O-N 3.5Å; K175-N177 PolarHBondContact O-ND2 2.87Å; N177-D179 PolarHBondContact O-N 2.88Å; N177-D179 VanDerWaalsContact O-N 3.09Å
178	I	41.7	Very low	36.2	Very low	147 Å²	147	142.5 Å²	142.5	75%	0.754	74%	0.741	S	S	*	*			trans	-81.2	83	165.1	-60.3	167.2	0	0	0	106.2	F180	I178-F180 PolarHBondContact O-N 3.18Å; I178-F180 VanDerWaalsContact O-N 3.14Å
179	D	35.7	Very low	36.9	Very low	119 Å²	119	135.4 Å²	135.4	64%	0.636	72%	0.718	S	S	*	*			trans	-68.2	106.4	165.5	-82.4	-53.1	0	0	0	107.5	N177	N177-D179 PolarHBondContact O-N 2.88Å; N177-D179 VanDerWaalsContact O-N 3.09Å
180	F	34.8	Very low	37.6	Very low	143 Å²	143	135.8 Å²	135.8	63%	0.627	71%	0.711	S	S	*	*			trans	-51.8	129.8	173.6	-84.3	-92.8	0	0	0	109.6	I22 I178 K182	I22-F180 HydrophobicContact CD1-CD2 4.21Å; I22-F180 HydrophobicContact CD1-CE2 4.23Å; I178-F180 PolarHBondContact O-N 3.18Å; I178-F180 VanDerWaalsContact O-N 3.14Å; F180-K182 PolarHBondContact O-N 3.49Å
181	P	37.1	Very low	38.5	Very low	108 Å²	108	133.1 Å²	133.1	70%	0.701	70%	0.701	S	S	*	*			trans	-57.1	105.7	173	-25.4	34.8	0	0	0	110.3	E183	P181-E183 HydrophobicContact CB-CG 4.23Å; P181-E183 PolarHBondContact O-N 3.17Å
182	K	38.5	Very low	39.6	Very low	158 Å²	158	130.2 Å²	130.2	69%	0.687	68%	0.684	S	S	*	*			trans	-72.6	35.6	168	-73.4	-175.1	173.5	179.8	0	110.9	T25 F180 N184	T25-K182 PolarHBondContact O-NZ 3.12Å; T25-K182 PolarHBondContact OG1-NZ 3.17Å; F180-K182 PolarHBondContact O-N 3.49Å; K182-N184 PolarHBondContact O-N 3.48Å
183	E	35.7	Very low	41.1	Very low	168 Å²	168	125.7 Å²	125.7	79%	0.785	66%	0.659	S	S	*	*			trans	-75.8	127.4	176.3	-67.5	-155.8	138.8	0	0	109.4	P181 I185	P181-E183 HydrophobicContact CB-CG 4.23Å; P181-E183 PolarHBondContact O-N 3.17Å; E183-I185 PolarHBondContact O-N 2.68Å
184	N	31.6	Very low	43.2	Very low	149 Å²	149	123.1 Å²	123.1	80%	0.797	64%	0.64	S	S	*	*			trans	-65.4	104	172.2	-81.2	-89.4	0	0	0	108.1	K182 S186	K182-N184 PolarHBondContact O-N 3.48Å; N184-S186 PolarHBondContact O-N 3.42Å
185	I	39.1	Very low	45.4	Very low	97 Å²	97	125.2 Å²	125.2	50%	0.497	63%	0.63	S	S	.	*			trans	-54.5	101.5	146.5	-57.3	167.6	0	0	0	104.4	F160 E183 L187	F160-I185 HydrophobicContact CD2-CD1 4.26Å; F160-I185 HydrophobicContact CE1-CD1 4.18Å; F160-I185 HydrophobicContact CE1-CG1 4.06Å; F160-I185 HydrophobicContact CE2-CD1 3.51Å; F160-I185 HydrophobicContact CE2-CG1 4.27Å; F160-I185 HydrophobicContact CZ-CD1 3.47Å; F160-I185 VanDerWaalsContact CZ-CD1 3.47Å; F160-I185 HydrophobicContact CZ-CG1 3.71Å; F160-I185 HydrophobicContact CZ-CG2 4.03Å; E183-I185 PolarHBondContact O-N 2.68Å; I185-L187 HydrophobicContact CG2-CB 4.43Å; I185-L187 HydrophobicContact CG2-CD1 3.91Å; I185-L187 HydrophobicContact CG2-CG 3.86Å; I185-L187 PolarHBondContact O-N 3.37Å
186	S	33.5	Very low	48	Very low	88 Å²	88	120.4 Å²	120.4	62%	0.615	61%	0.612	S	S	*	*			trans	-76.9	60.1	178.1	-155.4	0	0	0	0	109.3	N184 K188	N184-S186 PolarHBondContact O-N 3.42Å; S186-K188 PolarHBondContact O-N 3.03Å
187	L	41.4	Very low	50.8	Low	120 Å²	120	114.9 Å²	114.9	63%	0.628	58%	0.576	S	S	*	*			trans	-57.7	81.6	152.7	-88.4	161.3	0	0	0	106.8	I185 S189	I185-L187 HydrophobicContact CG2-CB 4.43Å; I185-L187 HydrophobicContact CG2-CD1 3.91Å; I185-L187 HydrophobicContact CG2-CG 3.86Å; I185-L187 PolarHBondContact O-N 3.37Å; L187-S189 PolarHBondContact O-N 2.65Å
188	K	36.9	Very low	53.6	Low	179 Å²	179	113.5 Å²	113.5	78%	0.778	56%	0.564	S	S	*	*			trans	-69.2	41.5	152.5	-63.2	-179.4	-178.1	175.3	0	109.8	S186 R190	S186-K188 PolarHBondContact O-N 3.03Å; K188-R190 PolarHBondContact O-N 3.15Å; K188-R190 VanDerWaalsContact O-N 3.1Å
189	S	47.6	Very low	56.1	Low	55 Å²	55	111 Å²	111	39%	0.385	55%	0.552	S	S	.	*			trans	-47	114	153.9	171.8	0	0	0	0	105.2	L187 D193	L187-S189 PolarHBondContact O-N 2.65Å; S189-D193 WeakPolarHBondContact CA-OD2 3.45Å
190	R	50.6	Low	58.8	Low	189 Å²	189	106 Å²	106	71%	0.713	53%	0.526	S	S	*	.			trans	-61.3	155.9	-178.9	-56.5	174.2	173.5	-168.3	-2.2	107.3	K188 A192 D193 R194	K188-R190 PolarHBondContact O-N 3.15Å; K188-R190 VanDerWaalsContact O-N 3.1Å; R190-A192 HydrophobicContact CB-CB 4.47Å; R190-A192 PolarHBondContact O-N 3.46Å; R190-A192 VanDerWaalsContact O-N 3.13Å; R190-D193 WeakPolarHBondContact CB-OD1 3.49Å; R190-D193 VanDerWaalsContact N-CG 3.34Å; R190-D193 PolarHBondContact N-OD2 3.09Å; R190-D193 WeakPolarHBondContact O-CB 3.36Å; R190-D193 PolarHBondContact O-N 3.26Å; R190-R194 PolarHBondContact O-N 2.59Å; R190-R194 VanDerWaalsContact O-N 3.08Å
191	V	56.6	Low	61.8	Low	97 Å²	97	99.2 Å²	99.2	59%	0.588	50%	0.496	S	S	*	.	H	α-helix	trans	-54.6	-36.2	176	-179.7	0	0	0	0	110.4	R194 W195	V191-R194 PolarHBondContact O-N 2.9Å; V191-W195 HydrophobicContact CG1-CD2 4.13Å; V191-W195 VanDerWaalsContact CG1-CE2 3.49Å; V191-W195 HydrophobicContact CG1-CH2 4.26Å; V191-W195 HydrophobicContact CG1-CZ2 3.58Å; V191-W195 VanDerWaalsContact O-CG 3.26Å; V191-W195 PolarHBondContact O-N 2.76Å; V191-W195 VanDerWaalsContact O-N 3.07Å
192	A	57.2	Low	64.6	Low	51 Å²	51	96.9 Å²	96.9	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-56.5	-53	169.1	0	0	0	0	0	113.5	R190 R194 W195 I196	R190-A192 HydrophobicContact CB-CB 4.47Å; R190-A192 PolarHBondContact O-N 3.46Å; R190-A192 VanDerWaalsContact O-N 3.13Å; A192-R194 VanDerWaalsContact C-N 3.26Å; A192-R194 PolarHBondContact O-N 2.85Å; A192-W195 CarbonylContact O-C 3.58Å; A192-W195 WeakPolarHBondContact O-CA 3.38Å; A192-W195 PolarHBondContact O-N 3.26Å; A192-I196 WeakPolarHBondContact O-CG1 3.39Å; A192-I196 PolarHBondContact O-N 2.94Å
193	D	72.1	Confident	67.4	Low	69 Å²	69	90 Å²	90	37%	0.369	46%	0.455	S	S	.	.	H	α-helix	trans	-58	-38.5	-180	-43	-13.3	0	0	0	111.5	S189 R190 W195 A197	S189-D193 WeakPolarHBondContact CA-OD2 3.45Å; R190-D193 WeakPolarHBondContact CB-OD1 3.49Å; R190-D193 VanDerWaalsContact N-CG 3.34Å; R190-D193 PolarHBondContact N-OD2 3.09Å; R190-D193 WeakPolarHBondContact O-CB 3.36Å; R190-D193 PolarHBondContact O-N 3.26Å; D193-W195 VanDerWaalsContact C-N 3.34Å; D193-A197 WeakPolarHBondContact O-CB 3.22Å; D193-A197 PolarHBondContact O-N 3.02Å
194	R	78	Confident	70.3	Confident	123 Å²	123	82 Å²	82	46%	0.464	42%	0.417	S	S	.	.	H	α-helix	trans	-71.5	-26.2	175.8	-167.6	176.4	-175.4	-164.8	0.7	113	R190 V191 A192 R198 M225	R190-R194 PolarHBondContact O-N 2.59Å; R190-R194 VanDerWaalsContact O-N 3.08Å; V191-R194 PolarHBondContact O-N 2.9Å; A192-R194 VanDerWaalsContact C-N 3.26Å; A192-R194 PolarHBondContact O-N 2.85Å; R194-R198 WeakPolarHBondContact O-CG 3.4Å; R194-R198 PolarHBondContact O-N 3.05Å; R194-M225 HydrophobicContact CG-CE 3.86Å
195	W	84.2	Confident	73.4	Confident	161 Å²	161	76.1 Å²	76.1	61%	0.61	39%	0.386	S	S	*	.	H	α-helix	trans	-77.9	-46.4	172.7	-66	-5	0	0	0	110.9	V191 A192 D193 A197 R198 D199	V191-W195 HydrophobicContact CG1-CD2 4.13Å; V191-W195 VanDerWaalsContact CG1-CE2 3.49Å; V191-W195 HydrophobicContact CG1-CH2 4.26Å; V191-W195 HydrophobicContact CG1-CZ2 3.58Å; V191-W195 VanDerWaalsContact O-CG 3.26Å; V191-W195 PolarHBondContact O-N 2.76Å; V191-W195 VanDerWaalsContact O-N 3.07Å; A192-W195 CarbonylContact O-C 3.58Å; A192-W195 WeakPolarHBondContact O-CA 3.38Å; A192-W195 PolarHBondContact O-N 3.26Å; D193-W195 VanDerWaalsContact C-N 3.34Å; W195-A197 VanDerWaalsContact C-N 3.28Å; W195-A197 PolarHBondContact O-N 3.37Å; W195-R198 CarbonylContact O-C 3.59Å; W195-R198 WeakPolarHBondContact O-CA 3.35Å; W195-R198 VanDerWaalsContact O-CB 3.28Å; W195-R198 WeakPolarHBondContact O-CB 3.4Å; W195-R198 PolarHBondContact O-N 3.41Å; W195-D199 VanDerWaalsContact O-CG 3.3Å; W195-D199 PolarHBondContact O-N 2.81Å
196	I	88.6	Confident	76.1	Confident	89 Å²	89	77.8 Å²	77.8	46%	0.456	39%	0.389	S	S	.	.	H	α-helix	trans	-54.5	-44.4	173	-66.8	162.5	0	0	0	111.1	A192 R198 D199 N200	A192-I196 WeakPolarHBondContact O-CG1 3.39Å; A192-I196 PolarHBondContact O-N 2.94Å; I196-R198 VanDerWaalsContact C-N 3.32Å; I196-R198 PolarHBondContact O-N 3.31Å; I196-D199 PolarHBondContact O-N 3.31Å; I196-N200 PolarHBondContact O-N 2.75Å; I196-N200 PolarHBondContact O-ND2 2.78Å; I196-N200 VanDerWaalsContact O-ND2 3.15Å
197	A	90.2	Very high	79.1	Confident	11 Å²	11	73.7 Å²	73.7	9%	0.091	36%	0.36	C	S	.	.	H	α-helix	trans	-59.3	-40.3	174.5	0	0	0	0	0	112.8	D193 W195 V201 M225	D193-A197 WeakPolarHBondContact O-CB 3.22Å; D193-A197 PolarHBondContact O-N 3.02Å; W195-A197 VanDerWaalsContact C-N 3.28Å; W195-A197 PolarHBondContact O-N 3.37Å; A197-V201 WeakPolarHBondContact O-CB 3.35Å; A197-V201 VanDerWaalsContact O-CG2 3.23Å; A197-V201 WeakPolarHBondContact O-CG2 3.42Å; A197-V201 PolarHBondContact O-N 3.17Å; A197-M225 HydrophobicContact CB-CE 4.16Å
198	R	93.8	Very high	81.6	Confident	62 Å²	62	68 Å²	68	23%	0.234	33%	0.33	C	S	.	.	H	α-helix	trans	-65.1	-41.5	174.3	-77.9	174.3	157.3	-87.6	175.6	112.3	R194 W195 I196 V201 S202 T221 N222 M225	R194-R198 WeakPolarHBondContact O-CG 3.4Å; R194-R198 PolarHBondContact O-N 3.05Å; W195-R198 CarbonylContact O-C 3.59Å; W195-R198 WeakPolarHBondContact O-CA 3.35Å; W195-R198 VanDerWaalsContact O-CB 3.28Å; W195-R198 WeakPolarHBondContact O-CB 3.4Å; W195-R198 PolarHBondContact O-N 3.41Å; I196-R198 VanDerWaalsContact C-N 3.32Å; I196-R198 PolarHBondContact O-N 3.31Å; R198-V201 PolarHBondContact O-N 2.8Å; R198-S202 VanDerWaalsContact O-CB 3.23Å; R198-S202 WeakPolarHBondContact O-CB 3.48Å; R198-S202 PolarHBondContact O-N 3.06Å; R198-T221 HydrophobicContact CB-CG2 3.76Å; R198-T221 HydrophobicContact CG-CG2 3.86Å; R198-T221 WeakPolarHBondContact O-CG2 3.44Å; R198-N222 VanDerWaalsContact CZ-OD1 3.31Å; R198-N222 PolarHBondContact NH1-OD1 2.92Å; R198-N222 PolarHBondContact NH2-OD1 3.37Å; R198-M225 HydrophobicContact CG-CE 4.26Å; R198-M225 HydrophobicContact CG-CG 3.88Å; R198-M225 HydrophobicContact CG-SD 4.47Å
199	D	93.9	Very high	84.2	Confident	96 Å²	96	64.3 Å²	64.3	51%	0.513	31%	0.314	S	S	.	.	H	α-helix	trans	-68.4	-39.2	-178.4	-60.6	-30.2	0	0	0	111.2	W195 I196 S202 A203	W195-D199 VanDerWaalsContact O-CG 3.3Å; W195-D199 PolarHBondContact O-N 2.81Å; I196-D199 PolarHBondContact O-N 3.31Å; D199-S202 PolarHBondContact O-N 2.93Å; D199-A203 WeakPolarHBondContact O-CB 3.15Å; D199-A203 PolarHBondContact O-N 2.95Å
200	N	94.2	Very high	86.3	Confident	14 Å²	14	64.7 Å²	64.7	8%	0.075	31%	0.312	C	S	.	.	H	α-helix	trans	-61.6	-47	171.8	-65.3	-28.8	0	0	0	112	L144 C147 I196 A203 F204	L144-N200 WeakPolarHBondContact CD2-O 3.25Å; C147-N200 PolarHBondContact SG-ND2 2.92Å; I196-N200 PolarHBondContact O-N 2.75Å; I196-N200 PolarHBondContact O-ND2 2.78Å; I196-N200 VanDerWaalsContact O-ND2 3.15Å; N200-A203 PolarHBondContact O-N 3.11Å; N200-F204 PolarHBondContact O-N 3.33Å
201	V	96.4	Very high	88.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.1	-42.5	176.6	169.2	0	0	0	0	111.1	L77 A197 R198 F204 I205 F219 T221 L224	L77-V201 HydrophobicContact CD1-CG2 4.19Å; A197-V201 WeakPolarHBondContact O-CB 3.35Å; A197-V201 VanDerWaalsContact O-CG2 3.23Å; A197-V201 WeakPolarHBondContact O-CG2 3.42Å; A197-V201 PolarHBondContact O-N 3.17Å; R198-V201 PolarHBondContact O-N 2.8Å; V201-F204 WeakPolarHBondContact O-CB 3.49Å; V201-F204 PolarHBondContact O-N 2.86Å; V201-I205 HydrophobicContact CG1-CD1 3.76Å; V201-I205 WeakPolarHBondContact O-CD1 3.33Å; V201-I205 WeakPolarHBondContact O-CG1 3.49Å; V201-I205 PolarHBondContact O-N 3.49Å; V201-F219 HydrophobicContact CG1-CE2 3.93Å; V201-T221 HydrophobicContact CB-CG2 4.23Å; V201-T221 HydrophobicContact CG1-CG2 4.04Å; V201-L224 HydrophobicContact CG1-CD2 3.98Å; V201-L224 HydrophobicContact CG2-CD2 3.94Å
202	S	96.7	Very high	89.6	Confident	59 Å²	59	52.5 Å²	52.5	41%	0.413	26%	0.263	S	S	.	.	H	α-helix	trans	-61.9	-44.9	177.3	-167.5	0	0	0	0	111.9	R198 D199 F204 I205 K206 T221	R198-S202 VanDerWaalsContact O-CB 3.23Å; R198-S202 WeakPolarHBondContact O-CB 3.48Å; R198-S202 PolarHBondContact O-N 3.06Å; D199-S202 PolarHBondContact O-N 2.93Å; S202-F204 VanDerWaalsContact C-N 3.32Å; S202-F204 PolarHBondContact O-N 2.86Å; S202-I205 PolarHBondContact O-N 2.98Å; S202-K206 PolarHBondContact O-N 2.77Å; S202-T221 WeakPolarHBondContact CA-OG1 3.26Å
203	A	96.5	Very high	91.1	Very high	14 Å²	14	50.1 Å²	50.1	12%	0.116	24%	0.244	C	C	.	.	H	α-helix	trans	-63.7	-35.6	175.3	0	0	0	0	0	112.4	P141 T143 L144 D199 N200 W207	P141-A203 HydrophobicContact CB-CB 4.47Å; T143-A203 VanDerWaalsContact OG1-CB 3.3Å; T143-A203 WeakPolarHBondContact OG1-CB 3.35Å; L144-A203 HydrophobicContact CD2-CB 3.89Å; L144-A203 HydrophobicContact CG-CB 3.93Å; D199-A203 WeakPolarHBondContact O-CB 3.15Å; D199-A203 PolarHBondContact O-N 2.95Å; N200-A203 PolarHBondContact O-N 3.11Å; A203-W207 WeakPolarHBondContact O-CB 3.38Å; A203-W207 PolarHBondContact O-N 2.9Å
204	F	97.7	Very high	91.8	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.4	-46.5	174.4	175.3	-92.1	0	0	0	111.9	L77 L80 A81 L144 N200 V201 S202 K206 W207 C208 F219 T236 L237	L77-F204 HydrophobicContact CB-CB 4.22Å; L77-F204 HydrophobicContact CB-CD1 4.22Å; L77-F204 HydrophobicContact CB-CD2 3.71Å; L77-F204 HydrophobicContact CB-CE2 4.11Å; L77-F204 HydrophobicContact CB-CG 3.77Å; L77-F204 HydrophobicContact CD1-CD1 4Å; L77-F204 HydrophobicContact CD1-CE1 4.43Å; L77-F204 HydrophobicContact CD1-CG 4.27Å; L77-F204 HydrophobicContact CD2-CD1 4.13Å; L77-F204 HydrophobicContact CD2-CD2 4.5Å; L77-F204 HydrophobicContact CD2-CE1 3.79Å; L77-F204 HydrophobicContact CD2-CE2 4.18Å; L77-F204 HydrophobicContact CD2-CG 4.48Å; L77-F204 HydrophobicContact CD2-CZ 3.82Å; L77-F204 HydrophobicContact CG-CD1 4.35Å; L77-F204 HydrophobicContact CG-CE1 4.5Å; L77-F204 HydrophobicContact CG-CG 4.4Å; L77-F204 WeakPolarHBondContact O-CD2 3.37Å; L80-F204 HydrophobicContact CD2-CE2 4.45Å; L80-F204 HydrophobicContact CD2-CZ 4.49Å; A81-F204 HydrophobicContact CB-CD2 3.92Å; A81-F204 HydrophobicContact CB-CE2 4.13Å; L144-F204 HydrophobicContact CD2-CB 4.09Å; N200-F204 PolarHBondContact O-N 3.33Å; V201-F204 WeakPolarHBondContact O-CB 3.49Å; V201-F204 PolarHBondContact O-N 2.86Å; S202-F204 VanDerWaalsContact C-N 3.32Å; S202-F204 PolarHBondContact O-N 2.86Å; F204-K206 VanDerWaalsContact C-N 3.3Å; F204-K206 PolarHBondContact O-N 3.24Å; F204-W207 HydrophobicContact CD2-CE3 4.33Å; F204-W207 HydrophobicContact CE2-CE3 4.24Å; F204-W207 HydrophobicContact CE2-CZ3 4.14Å; F204-W207 PolarHBondContact O-N 3.05Å; F204-C208 WeakPolarHBondContact CE1-SG 3.28Å; F204-C208 WeakPolarHBondContact CZ-SG 3.37Å; F204-C208 PolarHBondContact O-N 3.15Å; F204-C208 PolarHBondContact O-SG 3.35Å; F204-F219 HydrophobicContact CD1-CE1 4.48Å; F204-F219 HydrophobicContact CD1-CZ 4.07Å; F204-F219 HydrophobicContact CE1-CE1 4.19Å; F204-F219 HydrophobicContact CE1-CZ 4.16Å; F204-T236 HydrophobicContact CE1-CG2 4.31Å; F204-L237 HydrophobicContact CZ-CD2 4.28Å
205	I	96.9	Very high	92.4	Very high	25 Å²	25	48.4 Å²	48.4	13%	0.128	24%	0.241	C	C	.	.	H	α-helix	trans	-60.2	-43.1	176.7	-66.3	156.4	0	0	0	110.1	V201 S202 C208 K209 L218 F219 T221	V201-I205 HydrophobicContact CG1-CD1 3.76Å; V201-I205 WeakPolarHBondContact O-CD1 3.33Å; V201-I205 WeakPolarHBondContact O-CG1 3.49Å; V201-I205 PolarHBondContact O-N 3.49Å; S202-I205 PolarHBondContact O-N 2.98Å; I205-C208 PolarHBondContact O-N 3.44Å; I205-K209 PolarHBondContact O-N 3.25Å; I205-L218 HydrophobicContact CG2-CD1 4.37Å; I205-F219 HydrophobicContact CD1-CD2 3.95Å; I205-F219 HydrophobicContact CD1-CE2 3.73Å; I205-F219 HydrophobicContact CD1-CZ 4.33Å; I205-F219 VanDerWaalsContact CD1-O 3.23Å; I205-F219 WeakPolarHBondContact CD1-O 3.48Å; I205-F219 HydrophobicContact CG1-CD2 4.21Å; I205-F219 HydrophobicContact CG1-CE1 4.35Å; I205-F219 HydrophobicContact CG1-CE2 3.79Å; I205-F219 HydrophobicContact CG1-CZ 3.88Å; I205-T221 WeakPolarHBondContact CD1-OG1 3.49Å
206	K	95.4	Very high	92.7	Very high	131 Å²	131	46.3 Å²	46.3	57%	0.57	25%	0.246	S	C	*	.	H	α-helix	trans	-60.5	-50.3	174.6	-168.5	-164.3	170.8	-163.5	0	111.6	S202 F204 C208 K209 D210	S202-K206 PolarHBondContact O-N 2.77Å; F204-K206 VanDerWaalsContact C-N 3.3Å; F204-K206 PolarHBondContact O-N 3.24Å; K206-C208 VanDerWaalsContact C-N 3.27Å; K206-C208 PolarHBondContact O-N 3.06Å; K206-K209 WeakPolarHBondContact O-CB 3.48Å; K206-K209 PolarHBondContact O-N 3.05Å; K206-D210 VanDerWaalsContact CE-OD2 3.24Å; K206-D210 WeakPolarHBondContact CE-OD2 3.49Å; K206-D210 IonicContact NZ-OD2 2.62Å; K206-D210 VanDerWaalsContact O-CG 3.24Å; K206-D210 PolarHBondContact O-N 2.84Å
207	W	95.5	Very high	92.9	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-37.6	177.9	175.6	80.1	0	0	0	112.5	A81 L84 H85 L89 F140 P141 L144 A203 F204 D210 L211 V240	A81-W207 HydrophobicContact CB-CD2 3.93Å; A81-W207 HydrophobicContact CB-CE3 3.59Å; A81-W207 HydrophobicContact CB-CH2 3.82Å; A81-W207 HydrophobicContact CB-CZ2 4.1Å; A81-W207 HydrophobicContact CB-CZ3 3.55Å; L84-W207 HydrophobicContact CB-CH2 4.22Å; L84-W207 HydrophobicContact CD1-CH2 4.46Å; H85-W207 HydrophobicContact CB-CZ2 4.02Å; H85-W207 AromaticContact ND1-NE1 3.64Å; L89-W207 HydrophobicContact CD1-CZ2 4.06Å; F140-W207 AromaticContact CD2-CD1 3.82Å; F140-W207 AromaticContact CD2-NE1 3.43Å; F140-W207 HydrophobicContact CE2-CD2 4.4Å; F140-W207 AromaticContact CE2-CE2 3.86Å; F140-W207 HydrophobicContact CE2-CG 4.45Å; F140-W207 HydrophobicContact CE2-CZ2 4.31Å; F140-W207 AromaticContact CE2-NE1 3.6Å; P141-W207 HydrophobicContact CG-CB 4.32Å; L144-W207 HydrophobicContact CD1-CB 3.99Å; L144-W207 HydrophobicContact CD1-CG 4.3Å; A203-W207 WeakPolarHBondContact O-CB 3.38Å; A203-W207 PolarHBondContact O-N 2.9Å; F204-W207 HydrophobicContact CD2-CE3 4.33Å; F204-W207 HydrophobicContact CE2-CE3 4.24Å; F204-W207 HydrophobicContact CE2-CZ3 4.14Å; F204-W207 PolarHBondContact O-N 3.05Å; W207-D210 PolarHBondContact O-N 3.4Å; W207-L211 HydrophobicContact CD2-CD1 3.98Å; W207-L211 HydrophobicContact CE3-CD1 4.1Å; W207-L211 HydrophobicContact CH2-CD1 3.57Å; W207-L211 HydrophobicContact CZ2-CD1 3.44Å; W207-L211 VanDerWaalsContact CZ2-CD1 3.44Å; W207-L211 HydrophobicContact CZ2-CG 4.47Å; W207-L211 HydrophobicContact CZ3-CD1 3.9Å; W207-L211 WeakPolarHBondContact O-CG 3.49Å; W207-L211 PolarHBondContact O-N 2.92Å; W207-V240 HydrophobicContact CZ3-CG1 4.28Å
208	C	94.6	Very high	93.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-45.5	172.9	-65.5	0	0	0	0	112	F204 I205 K206 D210 L211 G212 V213 L218 T236 V240	F204-C208 WeakPolarHBondContact CE1-SG 3.28Å; F204-C208 WeakPolarHBondContact CZ-SG 3.37Å; F204-C208 PolarHBondContact O-N 3.15Å; F204-C208 PolarHBondContact O-SG 3.35Å; I205-C208 PolarHBondContact O-N 3.44Å; K206-C208 VanDerWaalsContact C-N 3.27Å; K206-C208 PolarHBondContact O-N 3.06Å; C208-D210 VanDerWaalsContact C-N 3.34Å; C208-D210 PolarHBondContact O-N 2.92Å; C208-L211 PolarHBondContact O-N 3.03Å; C208-G212 PolarHBondContact O-N 3.5Å; C208-V213 HydrophobicContact CB-CB 4.11Å; C208-V213 HydrophobicContact CB-CG2 3.99Å; C208-V213 VanDerWaalsContact O-CB 3.22Å; C208-V213 WeakPolarHBondContact O-CB 3.42Å; C208-V213 VanDerWaalsContact O-CG2 3.27Å; C208-V213 WeakPolarHBondContact O-CG2 3.27Å; C208-V213 PolarHBondContact O-N 3.01Å; C208-L218 HydrophobicContact CB-CD2 3.83Å; C208-T236 HydrophobicContact CB-CG2 4.42Å; C208-V240 HydrophobicContact CB-CG2 4.46Å
209	K	92.5	Very high	93.2	Very high	103 Å²	103	40.6 Å²	40.6	45%	0.448	22%	0.219	S	C	.	.	H	α-helix	trans	-60.6	-42.9	174.9	178.3	174.2	167.6	170.1	0	111.8	I205 K206 L211 G212 E215 L218	I205-K209 PolarHBondContact O-N 3.25Å; K206-K209 WeakPolarHBondContact O-CB 3.48Å; K206-K209 PolarHBondContact O-N 3.05Å; K209-L211 PolarHBondContact O-N 3.24Å; K209-G212 WeakPolarHBondContact O-CA 3.4Å; K209-G212 PolarHBondContact O-N 3.38Å; K209-E215 HydrophobicContact CD-CG 4.47Å; K209-E215 VanDerWaalsContact CE-OE1 3.23Å; K209-E215 WeakPolarHBondContact CE-OE1 3.19Å; K209-E215 IonicContact NZ-OE1 3.86Å; K209-E215 PolarHBondContact NZ-OE1 3.11Å; K209-L218 HydrophobicContact CB-CD1 3.81Å; K209-L218 HydrophobicContact CG-CD1 4.47Å
210	D	90.5	Very high	93.3	Very high	63 Å²	63	41.1 Å²	41.1	34%	0.337	22%	0.218	S	C	.	.	H	α-helix	trans	-68.4	-24	179.3	-62.8	-17.7	0	0	0	111.9	P138 K206 W207 C208 G212	P138-D210 HydrophobicContact CB-CB 3.68Å; P138-D210 HydrophobicContact CG-CB 3.86Å; K206-D210 VanDerWaalsContact CE-OD2 3.24Å; K206-D210 WeakPolarHBondContact CE-OD2 3.49Å; K206-D210 IonicContact NZ-OD2 2.62Å; K206-D210 VanDerWaalsContact O-CG 3.24Å; K206-D210 PolarHBondContact O-N 2.84Å; W207-D210 PolarHBondContact O-N 3.4Å; C208-D210 VanDerWaalsContact C-N 3.34Å; C208-D210 PolarHBondContact O-N 2.92Å; D210-G212 VanDerWaalsContact C-N 3.27Å
211	L	88.6	Confident	93.4	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	3.4	166.3	-72.5	-179.3	0	0	0	114.3	L89 L132 L137 P138 W207 C208 K209	L89-L211 HydrophobicContact CD1-CD1 3.83Å; L89-L211 HydrophobicContact CD1-CD2 3.85Å; L132-L211 VanDerWaalsContact CD1-O 3.31Å; L132-L211 WeakPolarHBondContact CD1-O 3.37Å; L137-L211 HydrophobicContact CD2-CD2 3.86Å; P138-L211 HydrophobicContact CG-CD2 3.97Å; P138-L211 HydrophobicContact CG-CG 4.36Å; W207-L211 HydrophobicContact CD2-CD1 3.98Å; W207-L211 HydrophobicContact CE3-CD1 4.1Å; W207-L211 HydrophobicContact CH2-CD1 3.57Å; W207-L211 HydrophobicContact CZ2-CD1 3.44Å; W207-L211 VanDerWaalsContact CZ2-CD1 3.44Å; W207-L211 HydrophobicContact CZ2-CG 4.47Å; W207-L211 HydrophobicContact CZ3-CD1 3.9Å; W207-L211 WeakPolarHBondContact O-CG 3.49Å; W207-L211 PolarHBondContact O-N 2.92Å; C208-L211 PolarHBondContact O-N 3.03Å; K209-L211 PolarHBondContact O-N 3.24Å
212	G	87.4	Confident	93.2	Very high	25 Å²	25	44.6 Å²	44.6	26%	0.258	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	15.5	179.1	0	0	0	0	0	115.5	L129 C208 K209 D210 P214	L129-G212 WeakPolarHBondContact CD1-O 3.22Å; C208-G212 PolarHBondContact O-N 3.5Å; K209-G212 WeakPolarHBondContact O-CA 3.4Å; K209-G212 PolarHBondContact O-N 3.38Å; D210-G212 VanDerWaalsContact C-N 3.27Å; G212-P214 WeakPolarHBondContact O-CD 3.24Å
213	V	90	Very high	93	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.012	22%	0.218	C	C	.	.			trans	-64.5	121.8	169.1	179.7	0	0	0	0	108.7	C208 I217 L218 E239 V240 I243	C208-V213 HydrophobicContact CB-CB 4.11Å; C208-V213 HydrophobicContact CB-CG2 3.99Å; C208-V213 VanDerWaalsContact O-CB 3.22Å; C208-V213 WeakPolarHBondContact O-CB 3.42Å; C208-V213 VanDerWaalsContact O-CG2 3.27Å; C208-V213 WeakPolarHBondContact O-CG2 3.27Å; C208-V213 PolarHBondContact O-N 3.01Å; V213-I217 HydrophobicContact CG1-CD1 3.99Å; V213-I217 HydrophobicContact CG1-CG1 4.05Å; V213-L218 HydrophobicContact CB-CD2 4.13Å; V213-L218 HydrophobicContact CG1-CD2 3.62Å; V213-L218 HydrophobicContact CG1-CG 4.12Å; V213-E239 HydrophobicContact CG1-CB 4.28Å; V213-E239 HydrophobicContact CG1-CG 4.31Å; V213-E239 HydrophobicContact CG2-CG 4.39Å; V213-V240 HydrophobicContact CG2-CG2 4.03Å; V213-I243 HydrophobicContact CG2-CD1 3.61Å
214	P	87.2	Confident	92.8	Very high	24 Å²	24	41.1 Å²	41.1	16%	0.156	21%	0.213	C	C	.	.			trans	-66	139.9	-173.1	-25.5	36.5	0	0	0	114.1	V124 G212 T216 I217 L218	V124-P214 HydrophobicContact CB-CG 4Å; V124-P214 HydrophobicContact CG1-CB 4.29Å; V124-P214 HydrophobicContact CG1-CG 3.91Å; V124-P214 WeakPolarHBondContact O-CG 3.13Å; G212-P214 WeakPolarHBondContact O-CD 3.24Å; P214-T216 PolarHBondContact O-N 2.76Å; P214-I217 VanDerWaalsContact O-CG1 3.28Å; P214-I217 WeakPolarHBondContact O-CG1 3.26Å; P214-I217 PolarHBondContact O-N 3.3Å; P214-L218 PolarHBondContact O-N 2.76Å
215	E	90.4	Very high	92.4	Very high	132 Å²	132	42.5 Å²	42.5	62%	0.617	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-27.5	179.1	-59.1	-172.6	145	0	0	113.3	K209 I217 L218	K209-E215 HydrophobicContact CD-CG 4.47Å; K209-E215 VanDerWaalsContact CE-OE1 3.23Å; K209-E215 WeakPolarHBondContact CE-OE1 3.19Å; K209-E215 IonicContact NZ-OE1 3.86Å; K209-E215 PolarHBondContact NZ-OE1 3.11Å; E215-I217 PolarHBondContact O-N 2.81Å; E215-L218 PolarHBondContact O-N 2.73Å
216	T	90.5	Very high	92	Very high	117 Å²	117	43.9 Å²	43.9	72%	0.718	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-12.4	178.4	52.2	0	0	0	0	114.7	P214	P214-T216 PolarHBondContact O-N 2.76Å
217	I	91.2	Very high	91.7	Very high	16 Å²	16	42 Å²	42	8%	0.082	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-8.5	174.3	62.7	164.3	0	0	0	114	V124 V213 P214 E215 N232 L235 T236 E239	V124-I217 HydrophobicContact CB-CD1 4.19Å; V124-I217 HydrophobicContact CG2-CD1 4.01Å; V124-I217 HydrophobicContact CG2-CG2 4.23Å; V213-I217 HydrophobicContact CG1-CD1 3.99Å; V213-I217 HydrophobicContact CG1-CG1 4.05Å; P214-I217 VanDerWaalsContact O-CG1 3.28Å; P214-I217 WeakPolarHBondContact O-CG1 3.26Å; P214-I217 PolarHBondContact O-N 3.3Å; E215-I217 PolarHBondContact O-N 2.81Å; I217-N232 VanDerWaalsContact O-O 3.13Å; I217-L235 HydrophobicContact CB-CB 4.15Å; I217-L235 HydrophobicContact CG2-CD1 4.4Å; I217-T236 PolarHBondContact O-OG1 3.21Å; I217-E239 HydrophobicContact CD1-CB 3.62Å; I217-E239 HydrophobicContact CD1-CG 3.86Å
218	L	94.5	Very high	91.5	Very high	20 Å²	20	43.4 Å²	43.4	11%	0.105	23%	0.228	C	C	.	.			trans	-62.6	153.7	171.4	-70.8	175.9	0	0	0	110.7	I205 C208 K209 V213 P214 E215 N232 T236	I205-L218 HydrophobicContact CG2-CD1 4.37Å; C208-L218 HydrophobicContact CB-CD2 3.83Å; K209-L218 HydrophobicContact CB-CD1 3.81Å; K209-L218 HydrophobicContact CG-CD1 4.47Å; V213-L218 HydrophobicContact CB-CD2 4.13Å; V213-L218 HydrophobicContact CG1-CD2 3.62Å; V213-L218 HydrophobicContact CG1-CG 4.12Å; P214-L218 PolarHBondContact O-N 2.76Å; E215-L218 PolarHBondContact O-N 2.73Å; L218-N232 PolarHBondContact O-ND2 3.13Å; L218-T236 WeakPolarHBondContact CA-OG1 3.31Å; L218-T236 HydrophobicContact CD2-CG2 3.87Å
219	F	96.2	Very high	91.4	Very high	5 Å²	5	45.5 Å²	45.5	2%	0.022	24%	0.238	C	C	.	.			trans	-107.2	153.8	172.8	62.1	-85.9	0	0	0	109.9	L77 V201 F204 I205 L224 E229 N232 V233 T236	L77-F219 HydrophobicContact CD1-CZ 4.21Å; V201-F219 HydrophobicContact CG1-CE2 3.93Å; F204-F219 HydrophobicContact CD1-CE1 4.48Å; F204-F219 HydrophobicContact CD1-CZ 4.07Å; F204-F219 HydrophobicContact CE1-CE1 4.19Å; F204-F219 HydrophobicContact CE1-CZ 4.16Å; I205-F219 HydrophobicContact CD1-CD2 3.95Å; I205-F219 HydrophobicContact CD1-CE2 3.73Å; I205-F219 HydrophobicContact CD1-CZ 4.33Å; I205-F219 VanDerWaalsContact CD1-O 3.23Å; I205-F219 WeakPolarHBondContact CD1-O 3.48Å; I205-F219 HydrophobicContact CG1-CD2 4.21Å; I205-F219 HydrophobicContact CG1-CE1 4.35Å; I205-F219 HydrophobicContact CG1-CE2 3.79Å; I205-F219 HydrophobicContact CG1-CZ 3.88Å; F219-L224 HydrophobicContact CD2-CB 3.76Å; F219-L224 HydrophobicContact CE2-CB 3.73Å; F219-L224 HydrophobicContact CE2-CD2 3.67Å; F219-L224 HydrophobicContact CE2-CG 4.33Å; F219-L224 HydrophobicContact CZ-CD2 4.21Å; F219-E229 WeakPolarHBondContact CA-OE2 3.43Å; F219-E229 HydrophobicContact CB-CB 4.42Å; F219-N232 HydrophobicContact CB-CB 3.72Å; F219-V233 HydrophobicContact CB-CG2 3.91Å; F219-V233 HydrophobicContact CD1-CB 4.22Å; F219-V233 HydrophobicContact CD1-CG2 3.87Å; F219-V233 HydrophobicContact CD2-CG2 3.76Å; F219-V233 HydrophobicContact CE1-CG2 4.3Å; F219-V233 HydrophobicContact CE2-CG2 4.21Å; F219-V233 HydrophobicContact CG-CB 4.4Å; F219-V233 HydrophobicContact CG-CG2 3.57Å; F219-V233 HydrophobicContact CZ-CG2 4.46Å; F219-T236 HydrophobicContact CD1-CG2 4.18Å; F219-T236 HydrophobicContact CE1-CG2 3.87Å
220	E	95.8	Very high	91.5	Very high	107 Å²	107	41.6 Å²	41.6	50%	0.5	22%	0.221	S	C	.	.			trans	-78.1	151.2	170.8	-75.9	-161.1	-170.3	0	0	112.2	N222 G223 L224 E229	E220-N222 HydrophobicContact CB-CB 4.33Å; E220-N222 PolarHBondContact O-N 3.14Å; E220-N222 PolarHBondContact OE2-ND2 3.31Å; E220-G223 WeakPolarHBondContact O-CA 3.32Å; E220-G223 PolarHBondContact O-N 3.4Å; E220-L224 PolarHBondContact O-N 3.49Å; E220-L224 VanDerWaalsContact O-N 3.07Å; E220-E229 PolarHBondContact N-OE2 3.34Å
221	T	95.9	Very high	91.7	Very high	23 Å²	23	40.9 Å²	40.9	14%	0.141	22%	0.215	C	C	.	.	H	α-helix	trans	-53.2	-34.2	164.4	-53.8	0	0	0	0	111.9	R198 V201 S202 I205 M225	R198-T221 HydrophobicContact CB-CG2 3.76Å; R198-T221 HydrophobicContact CG-CG2 3.86Å; R198-T221 WeakPolarHBondContact O-CG2 3.44Å; V201-T221 HydrophobicContact CB-CG2 4.23Å; V201-T221 HydrophobicContact CG1-CG2 4.04Å; S202-T221 WeakPolarHBondContact CA-OG1 3.26Å; I205-T221 WeakPolarHBondContact CD1-OG1 3.49Å; T221-M225 VanDerWaalsContact O-CB 3.29Å; T221-M225 WeakPolarHBondContact O-CB 3.38Å; T221-M225 WeakPolarHBondContact O-CG 3.4Å; T221-M225 PolarHBondContact O-N 3.25Å
222	N	92.7	Very high	92	Very high	65 Å²	65	42.7 Å²	42.7	35%	0.348	22%	0.224	S	C	.	.	H	α-helix	trans	-68.8	-44.8	170.9	-63.7	-49.2	0	0	0	112	R198 E220 L224 M225 N226	R198-N222 VanDerWaalsContact CZ-OD1 3.31Å; R198-N222 PolarHBondContact NH1-OD1 2.92Å; R198-N222 PolarHBondContact NH2-OD1 3.37Å; E220-N222 HydrophobicContact CB-CB 4.33Å; E220-N222 PolarHBondContact O-N 3.14Å; E220-N222 PolarHBondContact OE2-ND2 3.31Å; N222-L224 PolarHBondContact O-N 3.14Å; N222-M225 PolarHBondContact O-N 3.41Å; N222-N226 VanDerWaalsContact O-CB 3.24Å; N222-N226 WeakPolarHBondContact O-CB 3.12Å; N222-N226 VanDerWaalsContact O-CG 3.31Å; N222-N226 PolarHBondContact O-N 2.95Å; N222-N226 PolarHBondContact O-ND2 2.92Å
223	G	92.1	Very high	92.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-52.5	-47.6	-179.6	0	0	0	0	0	114	E220 K227 T228 E229	E220-G223 WeakPolarHBondContact O-CA 3.32Å; E220-G223 PolarHBondContact O-N 3.4Å; G223-K227 CarbonylContact O-C 3.58Å; G223-K227 WeakPolarHBondContact O-CA 3.21Å; G223-K227 PolarHBondContact O-N 3.1Å; G223-T228 WeakPolarHBondContact CA-OG1 3.38Å; G223-T228 PolarHBondContact O-N 3.46Å; G223-E229 VanDerWaalsContact CA-CD 3.45Å; G223-E229 PolarHBondContact O-N 2.92Å
224	L	93.5	Very high	92.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-72.8	-49.5	175.1	174.6	57.2	0	0	0	112.3	L68 L71 L77 V201 F219 E220 N222 N226 K227 V233	L68-L224 HydrophobicContact CB-CD1 4.32Å; L68-L224 HydrophobicContact CG-CD1 3.86Å; L71-L224 HydrophobicContact CB-CD1 4Å; L71-L224 HydrophobicContact CB-CD2 4.06Å; L77-L224 HydrophobicContact CD1-CD2 3.73Å; V201-L224 HydrophobicContact CG1-CD2 3.98Å; V201-L224 HydrophobicContact CG2-CD2 3.94Å; F219-L224 HydrophobicContact CD2-CB 3.76Å; F219-L224 HydrophobicContact CE2-CB 3.73Å; F219-L224 HydrophobicContact CE2-CD2 3.67Å; F219-L224 HydrophobicContact CE2-CG 4.33Å; F219-L224 HydrophobicContact CZ-CD2 4.21Å; E220-L224 PolarHBondContact O-N 3.49Å; E220-L224 VanDerWaalsContact O-N 3.07Å; N222-L224 PolarHBondContact O-N 3.14Å; L224-N226 PolarHBondContact O-N 2.91Å; L224-N226 VanDerWaalsContact O-N 3.17Å; L224-K227 PolarHBondContact O-N 2.95Å; L224-V233 HydrophobicContact CB-CG2 4.18Å; L224-V233 HydrophobicContact CD1-CG2 4.13Å
225	M	89.9	Confident	93.1	Very high	29 Å²	29	42.6 Å²	42.6	14%	0.143	22%	0.216	C	C	.	.	H	α-helix	trans	-64.2	-23.8	-175.8	-69.6	-61	-70	0	0	113.9	A72 R194 A197 R198 T221 N222	A72-M225 HydrophobicContact CB-SD 4.09Å; R194-M225 HydrophobicContact CG-CE 3.86Å; A197-M225 HydrophobicContact CB-CE 4.16Å; R198-M225 HydrophobicContact CG-CE 4.26Å; R198-M225 HydrophobicContact CG-CG 3.88Å; R198-M225 HydrophobicContact CG-SD 4.47Å; T221-M225 VanDerWaalsContact O-CB 3.29Å; T221-M225 WeakPolarHBondContact O-CB 3.38Å; T221-M225 WeakPolarHBondContact O-CG 3.4Å; T221-M225 PolarHBondContact O-N 3.25Å; N222-M225 PolarHBondContact O-N 3.41Å
226	N	87.3	Confident	93.4	Very high	54 Å²	54	36.3 Å²	36.3	29%	0.289	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-6.4	176.4	-58.8	-17.4	0	0	0	112.3	H29 N222 L224 T228	H29-N226 PolarHBondContact CE1-O 3.34Å; N222-N226 VanDerWaalsContact O-CB 3.24Å; N222-N226 WeakPolarHBondContact O-CB 3.12Å; N222-N226 VanDerWaalsContact O-CG 3.31Å; N222-N226 PolarHBondContact O-N 2.95Å; N222-N226 PolarHBondContact O-ND2 2.92Å; L224-N226 PolarHBondContact O-N 2.91Å; L224-N226 VanDerWaalsContact O-N 3.17Å; N226-T228 VanDerWaalsContact C-N 3.32Å; N226-T228 HydrophobicContact CB-CG2 4.07Å; N226-T228 PolarHBondContact O-N 2.77Å
227	K	89.9	Confident	93.7	Very high	90 Å²	90	30.7 Å²	30.7	39%	0.391	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	35.8	-176	-46.6	178.3	-175	174.1	0	114.3	L68 C69 G223 L224	L68-K227 HydrophobicContact CB-CG 4.36Å; L68-K227 HydrophobicContact CD2-CB 3.99Å; L68-K227 HydrophobicContact CD2-CG 4.2Å; C69-K227 PolarHBondContact SG-NZ 3.25Å; G223-K227 CarbonylContact O-C 3.58Å; G223-K227 WeakPolarHBondContact O-CA 3.21Å; G223-K227 PolarHBondContact O-N 3.1Å; L224-K227 PolarHBondContact O-N 2.95Å
228	T	90.8	Very high	93.8	Very high	32 Å²	32	30.3 Å²	30.3	20%	0.196	15%	0.151	C	C	.	.	S	Bend	trans	-92.7	-15.6	177.6	55.4	0	0	0	0	113.6	Q32 G223 N226	Q32-T228 WeakPolarHBondContact CB-O 3.45Å; G223-T228 WeakPolarHBondContact CA-OG1 3.38Å; G223-T228 PolarHBondContact O-N 3.46Å; N226-T228 VanDerWaalsContact C-N 3.32Å; N226-T228 HydrophobicContact CB-CG2 4.07Å; N226-T228 PolarHBondContact O-N 2.77Å
229	E	92.7	Very high	93.7	Very high	45 Å²	45	29.3 Å²	29.3	21%	0.21	15%	0.146	C	C	.	.			trans	-127.6	37.5	-171	-67.1	172.7	-159.7	0	0	112.7	F219 E220 G223 K231 N232 V233	F219-E229 WeakPolarHBondContact CA-OE2 3.43Å; F219-E229 HydrophobicContact CB-CB 4.42Å; E220-E229 PolarHBondContact N-OE2 3.34Å; G223-E229 VanDerWaalsContact CA-CD 3.45Å; G223-E229 PolarHBondContact O-N 2.92Å; E229-K231 PolarHBondContact O-N 2.69Å; E229-K231 VanDerWaalsContact O-N 3.14Å; E229-N232 HydrophobicContact CB-CB 4.38Å; E229-N232 PolarHBondContact O-N 3.47Å; E229-V233 PolarHBondContact O-N 2.86Å; E229-V233 VanDerWaalsContact O-N 3.13Å
230	E	94.7	Very high	93.6	Very high	20 Å²	20	29.2 Å²	29.2	9%	0.093	15%	0.145	C	C	.	.	H	α-helix	trans	-48.6	-42.5	-179.8	-173.4	163.4	176.1	0	0	112.6	Q32 L34 R42 L68 N232 V233 L234	Q32-E230 VanDerWaalsContact OE1-N 3.1Å; L34-E230 HydrophobicContact CD1-CG 3.97Å; L34-E230 HydrophobicContact CD2-CB 4.13Å; L34-E230 HydrophobicContact CD2-CG 4.04Å; L34-E230 HydrophobicContact CG-CG 4.17Å; R42-E230 WeakPolarHBondContact CD-OE1 3.39Å; R42-E230 IonicContact CZ-OE1 3.17Å; R42-E230 IonicContact NE-OE1 3.64Å; R42-E230 IonicContact NH1-OE1 2.82Å; R42-E230 PolarHBondContact NH1-OE1 3.45Å; L68-E230 HydrophobicContact CD1-CB 4.49Å; L68-E230 HydrophobicContact CD1-CG 3.76Å; L68-E230 HydrophobicContact CD2-CB 3.65Å; L68-E230 HydrophobicContact CD2-CG 3.7Å; L68-E230 HydrophobicContact CG-CG 4.38Å; E230-N232 PolarHBondContact O-N 2.71Å; E230-V233 WeakPolarHBondContact O-CB 3.47Å; E230-V233 PolarHBondContact O-N 2.93Å; E230-L234 HydrophobicContact CG-CD1 4.44Å; E230-L234 VanDerWaalsContact O-CG 3.3Å; E230-L234 WeakPolarHBondContact O-CG 3.42Å; E230-L234 PolarHBondContact O-N 2.96Å; E230-L234 VanDerWaalsContact O-N 3.1Å
231	K	94.6	Very high	93.5	Very high	48 Å²	48	24.1 Å²	24.1	21%	0.209	12%	0.122	C	C	.	.	H	α-helix	trans	-60.2	-42.8	176.9	-175.7	177.2	175.7	-179.3	0	113.3	Q32 L34 M38 E229 L234 L235	Q32-K231 VanDerWaalsContact OE1-CB 3.3Å; L34-K231 HydrophobicContact CD2-CB 4.14Å; M38-K231 HydrophobicContact CG-CG 4.35Å; M38-K231 HydrophobicContact SD-CG 4.05Å; E229-K231 PolarHBondContact O-N 2.69Å; E229-K231 VanDerWaalsContact O-N 3.14Å; K231-L234 PolarHBondContact O-N 2.69Å; K231-L235 HydrophobicContact CG-CD1 4.05Å; K231-L235 HydrophobicContact CG-CG 4.49Å; K231-L235 VanDerWaalsContact O-CG 3.31Å; K231-L235 WeakPolarHBondContact O-CG 3.1Å; K231-L235 PolarHBondContact O-N 2.78Å
232	N	95.1	Very high	93.3	Very high	42 Å²	42	23.4 Å²	23.4	23%	0.225	12%	0.116	C	C	.	.	H	α-helix	trans	-72.4	-34	-178.5	-72	42	0	0	0	111.2	I217 L218 F219 E229 E230 L234 L235 T236	I217-N232 VanDerWaalsContact O-O 3.13Å; L218-N232 PolarHBondContact O-ND2 3.13Å; F219-N232 HydrophobicContact CB-CB 3.72Å; E229-N232 HydrophobicContact CB-CB 4.38Å; E229-N232 PolarHBondContact O-N 3.47Å; E230-N232 PolarHBondContact O-N 2.71Å; N232-L234 VanDerWaalsContact C-N 3.35Å; N232-L234 PolarHBondContact O-N 2.98Å; N232-L235 PolarHBondContact O-N 3.37Å; N232-T236 WeakPolarHBondContact O-CB 3.26Å; N232-T236 PolarHBondContact O-N 3.09Å; N232-T236 PolarHBondContact O-OG1 3.38Å
233	V	96.8	Very high	93.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58.2	-47.7	170.8	177.8	0	0	0	0	110.6	L68 L71 F219 L224 E229 E230 L237	L68-V233 HydrophobicContact CD1-CG1 4.32Å; L71-V233 HydrophobicContact CD1-CG1 3.57Å; F219-V233 HydrophobicContact CB-CG2 3.91Å; F219-V233 HydrophobicContact CD1-CB 4.22Å; F219-V233 HydrophobicContact CD1-CG2 3.87Å; F219-V233 HydrophobicContact CD2-CG2 3.76Å; F219-V233 HydrophobicContact CE1-CG2 4.3Å; F219-V233 HydrophobicContact CE2-CG2 4.21Å; F219-V233 HydrophobicContact CG-CB 4.4Å; F219-V233 HydrophobicContact CG-CG2 3.57Å; F219-V233 HydrophobicContact CZ-CG2 4.46Å; L224-V233 HydrophobicContact CB-CG2 4.18Å; L224-V233 HydrophobicContact CD1-CG2 4.13Å; E229-V233 PolarHBondContact O-N 2.86Å; E229-V233 VanDerWaalsContact O-N 3.13Å; E230-V233 WeakPolarHBondContact O-CB 3.47Å; E230-V233 PolarHBondContact O-N 2.93Å; V233-L237 HydrophobicContact CG1-CD1 4.1Å; V233-L237 VanDerWaalsContact O-CG 3.31Å; V233-L237 WeakPolarHBondContact O-CG 3.3Å; V233-L237 PolarHBondContact O-N 3.33Å; V233-L237 VanDerWaalsContact O-N 3.14Å
234	L	96.6	Very high	93	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64.6	-44.9	177.9	-62	173.3	0	0	0	112.5	L34 M38 V41 R42 L45 L67 E230 K231 N232 L237 M238	L34-L234 HydrophobicContact CD1-CD1 3.82Å; L34-L234 HydrophobicContact CD2-CD1 4.49Å; M38-L234 HydrophobicContact CB-CD1 4.48Å; V41-L234 HydrophobicContact CG1-CB 4.1Å; R42-L234 HydrophobicContact CB-CD1 3.89Å; R42-L234 HydrophobicContact CB-CD2 3.87Å; R42-L234 HydrophobicContact CG-CD2 4.07Å; L45-L234 HydrophobicContact CD1-CB 4.09Å; L45-L234 HydrophobicContact CD1-CD2 3.7Å; L45-L234 WeakPolarHBondContact CD1-O 3.36Å; L67-L234 HydrophobicContact CD2-CD2 3.89Å; E230-L234 HydrophobicContact CG-CD1 4.44Å; E230-L234 VanDerWaalsContact O-CG 3.3Å; E230-L234 WeakPolarHBondContact O-CG 3.42Å; E230-L234 PolarHBondContact O-N 2.96Å; E230-L234 VanDerWaalsContact O-N 3.1Å; K231-L234 PolarHBondContact O-N 2.69Å; N232-L234 VanDerWaalsContact C-N 3.35Å; N232-L234 PolarHBondContact O-N 2.98Å; L234-L237 PolarHBondContact O-N 3.49Å; L234-M238 WeakPolarHBondContact O-CG 3.48Å; L234-M238 PolarHBondContact O-N 3.25Å
235	L	94.1	Very high	92.7	Very high	49 Å²	49	20.6 Å²	20.6	26%	0.257	10%	0.102	S	C	.	.	H	α-helix	trans	-64.5	-40.1	178.7	-70	172.3	0	0	0	112.4	I217 K231 N232 M238 E239	I217-L235 HydrophobicContact CB-CB 4.15Å; I217-L235 HydrophobicContact CG2-CD1 4.4Å; K231-L235 HydrophobicContact CG-CD1 4.05Å; K231-L235 HydrophobicContact CG-CG 4.49Å; K231-L235 VanDerWaalsContact O-CG 3.31Å; K231-L235 WeakPolarHBondContact O-CG 3.1Å; K231-L235 PolarHBondContact O-N 2.78Å; N232-L235 PolarHBondContact O-N 3.37Å; L235-M238 PolarHBondContact O-N 2.76Å; L235-E239 PolarHBondContact O-N 2.88Å
236	T	95.6	Very high	92.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.2	-46.6	174.7	-64.6	0	0	0	0	111.4	F204 C208 I217 L218 F219 N232 E239 V240	F204-T236 HydrophobicContact CE1-CG2 4.31Å; C208-T236 HydrophobicContact CB-CG2 4.42Å; I217-T236 PolarHBondContact O-OG1 3.21Å; L218-T236 WeakPolarHBondContact CA-OG1 3.31Å; L218-T236 HydrophobicContact CD2-CG2 3.87Å; F219-T236 HydrophobicContact CD1-CG2 4.18Å; F219-T236 HydrophobicContact CE1-CG2 3.87Å; N232-T236 WeakPolarHBondContact O-CB 3.26Å; N232-T236 PolarHBondContact O-N 3.09Å; N232-T236 PolarHBondContact O-OG1 3.38Å; T236-E239 PolarHBondContact O-N 3.21Å; T236-V240 HydrophobicContact CG2-CG2 4.49Å; T236-V240 WeakPolarHBondContact O-CG2 3.33Å; T236-V240 PolarHBondContact O-N 3.22Å
237	L	97.1	Very high	92.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-65.7	-39.1	-180	-70.8	167.6	0	0	0	112.5	L45 L49 L71 L77 L80 F204 V233 L234 V240 A241	L45-L237 HydrophobicContact CD1-CB 3.77Å; L45-L237 HydrophobicContact CD1-CD1 4.3Å; L45-L237 HydrophobicContact CD2-CB 4.01Å; L49-L237 HydrophobicContact CD1-CD1 4.18Å; L71-L237 HydrophobicContact CD1-CD1 3.86Å; L77-L237 HydrophobicContact CD2-CD2 4.07Å; L80-L237 HydrophobicContact CD2-CD2 3.52Å; F204-L237 HydrophobicContact CZ-CD2 4.28Å; V233-L237 HydrophobicContact CG1-CD1 4.1Å; V233-L237 VanDerWaalsContact O-CG 3.31Å; V233-L237 WeakPolarHBondContact O-CG 3.3Å; V233-L237 PolarHBondContact O-N 3.33Å; V233-L237 VanDerWaalsContact O-N 3.14Å; L234-L237 PolarHBondContact O-N 3.49Å; L237-V240 PolarHBondContact O-N 3.23Å; L237-A241 PolarHBondContact O-N 3.07Å
238	M	94.4	Very high	92.1	Very high	7 Å²	7	17.8 Å²	17.8	3%	0.034	9%	0.091	C	C	.	.	H	α-helix	trans	-60.8	-43.6	171.8	-73.9	-68.4	-75.4	0	0	111.8	V41 L45 L234 L235 A241 R242 P253 L255 V256	V41-M238 HydrophobicContact CG1-CG 3.96Å; V41-M238 HydrophobicContact CG1-SD 4.3Å; L45-M238 HydrophobicContact CD1-CG 4.12Å; L45-M238 HydrophobicContact CD2-CG 4.44Å; L45-M238 HydrophobicContact CD2-SD 4.09Å; L45-M238 HydrophobicContact CG-CG 4.49Å; L45-M238 HydrophobicContact CG-SD 4.29Å; L234-M238 WeakPolarHBondContact O-CG 3.48Å; L234-M238 PolarHBondContact O-N 3.25Å; L235-M238 PolarHBondContact O-N 2.76Å; M238-A241 PolarHBondContact O-N 3.47Å; M238-R242 VanDerWaalsContact O-CG 3.3Å; M238-R242 WeakPolarHBondContact O-CG 3.35Å; M238-R242 PolarHBondContact O-N 3.09Å; M238-P253 HydrophobicContact SD-CB 4.46Å; M238-L255 HydrophobicContact CE-CB 3.84Å; M238-V256 HydrophobicContact CE-CG2 3.48Å; M238-V256 VanDerWaalsContact CE-CG2 3.48Å; M238-V256 HydrophobicContact SD-CG2 3.73Å
239	E	92.7	Very high	92.1	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-68.4	-40.4	179.5	-162.1	67.3	-167.1	0	0	112.4	A123 V124 S125 V213 I217 L235 T236 A241 R242 I243	A123-E239 VanDerWaalsContact C-OE1 3.27Å; A123-E239 VanDerWaalsContact CA-OE1 3.29Å; A123-E239 WeakPolarHBondContact CA-OE1 3.38Å; A123-E239 WeakPolarHBondContact CA-OE2 3.47Å; A123-E239 WeakPolarHBondContact CB-OE1 3.48Å; V124-E239 VanDerWaalsContact N-CD 3.28Å; V124-E239 PolarHBondContact N-OE1 3.12Å; V124-E239 PolarHBondContact N-OE2 3.25Å; V124-E239 VanDerWaalsContact N-OE2 3.09Å; S125-E239 PolarHBondContact N-OE1 3.29Å; V213-E239 HydrophobicContact CG1-CB 4.28Å; V213-E239 HydrophobicContact CG1-CG 4.31Å; V213-E239 HydrophobicContact CG2-CG 4.39Å; I217-E239 HydrophobicContact CD1-CB 3.62Å; I217-E239 HydrophobicContact CD1-CG 3.86Å; L235-E239 PolarHBondContact O-N 2.88Å; T236-E239 PolarHBondContact O-N 3.21Å; E239-A241 VanDerWaalsContact C-N 3.3Å; E239-A241 PolarHBondContact O-N 3.01Å; E239-R242 WeakPolarHBondContact O-CB 3.38Å; E239-R242 PolarHBondContact O-N 3.39Å; E239-R242 VanDerWaalsContact OE2-CD 3.31Å; E239-R242 WeakPolarHBondContact OE2-CD 3.29Å; E239-R242 IonicContact OE2-CZ 3.11Å; E239-R242 IonicContact OE2-NE 3.93Å; E239-R242 IonicContact OE2-NH1 2.67Å; E239-R242 PolarHBondContact OE2-NH1 3.42Å; E239-I243 HydrophobicContact CG-CD1 4.36Å; E239-I243 WeakPolarHBondContact O-CG1 3.31Å; E239-I243 PolarHBondContact O-N 2.92Å
240	V	93.9	Very high	92	Very high	3 Å²	3	19.6 Å²	19.6	2%	0.018	11%	0.106	C	C	.	.	H	α-helix	trans	-59.4	-41.1	172.9	169.4	0	0	0	0	111.3	L84 W207 C208 V213 T236 L237 I243 A244	L84-V240 HydrophobicContact CD1-CG1 3.44Å; L84-V240 VanDerWaalsContact CD1-CG1 3.44Å; W207-V240 HydrophobicContact CZ3-CG1 4.28Å; C208-V240 HydrophobicContact CB-CG2 4.46Å; V213-V240 HydrophobicContact CG2-CG2 4.03Å; T236-V240 HydrophobicContact CG2-CG2 4.49Å; T236-V240 WeakPolarHBondContact O-CG2 3.33Å; T236-V240 PolarHBondContact O-N 3.22Å; L237-V240 PolarHBondContact O-N 3.23Å; V240-I243 PolarHBondContact O-N 3.41Å; V240-A244 WeakPolarHBondContact O-CB 3.24Å; V240-A244 PolarHBondContact O-N 3.36Å
241	A	93.9	Very high	91.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-66.2	-40	174.8	0	0	0	0	0	112.8	W48 L237 M238 E239 A244 S245 L252 P253 V256	W48-A241 HydrophobicContact CH2-CB 3.93Å; W48-A241 HydrophobicContact CZ2-CB 4.21Å; W48-A241 HydrophobicContact CZ3-CB 4.43Å; L237-A241 PolarHBondContact O-N 3.07Å; M238-A241 PolarHBondContact O-N 3.47Å; E239-A241 VanDerWaalsContact C-N 3.3Å; E239-A241 PolarHBondContact O-N 3.01Å; A241-A244 PolarHBondContact O-N 2.77Å; A241-S245 PolarHBondContact O-N 3.49Å; A241-L252 HydrophobicContact CB-CD2 4.48Å; A241-L252 WeakPolarHBondContact O-CD2 3.36Å; A241-P253 HydrophobicContact CB-CG 3.85Å; A241-V256 HydrophobicContact CB-CG2 4.29Å
242	R	90.8	Very high	91.8	Very high	8 Å²	8	18.2 Å²	18.2	3%	0.03	10%	0.101	C	C	.	.	H	α-helix	trans	-62.9	-42.3	174.1	-71.5	162.5	173.8	172.3	-4.7	112.4	L120 G122 A123 M238 E239 S245 V256 E259 G541	L120-R242 HydrophobicContact CD1-CB 4.02Å; L120-R242 HydrophobicContact CD1-CG 4.05Å; G122-R242 PolarHBondContact O-NH1 2.93Å; A123-R242 HydrophobicContact CB-CB 4.41Å; M238-R242 VanDerWaalsContact O-CG 3.3Å; M238-R242 WeakPolarHBondContact O-CG 3.35Å; M238-R242 PolarHBondContact O-N 3.09Å; E239-R242 WeakPolarHBondContact O-CB 3.38Å; E239-R242 PolarHBondContact O-N 3.39Å; E239-R242 VanDerWaalsContact OE2-CD 3.31Å; E239-R242 WeakPolarHBondContact OE2-CD 3.29Å; E239-R242 IonicContact OE2-CZ 3.11Å; E239-R242 IonicContact OE2-NE 3.93Å; E239-R242 IonicContact OE2-NH1 2.67Å; E239-R242 PolarHBondContact OE2-NH1 3.42Å; R242-S245 WeakPolarHBondContact O-CB 3.31Å; R242-S245 PolarHBondContact O-N 3.06Å; R242-V256 HydrophobicContact CG-CG1 3.83Å; R242-V256 HydrophobicContact CG-CG2 4.3Å; R242-E259 IonicContact CZ-OE1 3.12Å; R242-E259 IonicContact CZ-OE2 3.76Å; R242-E259 IonicContact NE-OE1 2.68Å; R242-E259 IonicContact NE-OE2 2.78Å; R242-E259 PolarHBondContact NE-OE2 3.09Å; R242-E259 IonicContact NH2-OE1 3.85Å; R242-E259 PolarHBondContact NH2-OE1 2.88Å; R242-E259 IonicContact NH2-OE2 3.97Å; R242-E259 PolarHBondContact NH2-OE2 2.8Å; R242-G541 PolarHBondContact NH1-O 2.9Å; R242-G541 PolarHBondContact NH2-O 2.89Å
243	I	88.6	Confident	91.9	Very high	3 Å²	3	16.2 Å²	16.2	2%	0.015	9%	0.091	C	C	.	.	H	α-helix	trans	-61.4	-51.9	174.6	-68.2	168	0	0	0	109.2	L129 V213 E239 V240 S245 R246 Y247	L129-I243 HydrophobicContact CD1-CD1 4.13Å; L129-I243 HydrophobicContact CD1-CG1 4.32Å; L129-I243 HydrophobicContact CD2-CD1 4.3Å; L129-I243 HydrophobicContact CD2-CG1 4.06Å; L129-I243 HydrophobicContact CD2-CG2 4.16Å; V213-I243 HydrophobicContact CG2-CD1 3.61Å; E239-I243 HydrophobicContact CG-CD1 4.36Å; E239-I243 WeakPolarHBondContact O-CG1 3.31Å; E239-I243 PolarHBondContact O-N 2.92Å; V240-I243 PolarHBondContact O-N 3.41Å; I243-S245 VanDerWaalsContact C-N 3.26Å; I243-S245 PolarHBondContact O-N 3.14Å; I243-R246 WeakPolarHBondContact O-CB 3.46Å; I243-R246 PolarHBondContact O-N 2.86Å; I243-Y247 HydrophobicContact CG2-CE2 4.04Å; I243-Y247 VanDerWaalsContact O-CD2 3.28Å; I243-Y247 WeakPolarHBondContact O-CD2 3.39Å
244	A	90	Very high	91.8	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.008	11%	0.109	C	C	.	.	H	α-helix	trans	-60	-31.7	178.8	0	0	0	0	0	113.6	L84 V240 A241 R246 Y247 G248 L249	L84-A244 HydrophobicContact CD2-CB 3.83Å; V240-A244 WeakPolarHBondContact O-CB 3.24Å; V240-A244 PolarHBondContact O-N 3.36Å; A241-A244 PolarHBondContact O-N 2.77Å; A244-R246 PolarHBondContact O-N 3.47Å; A244-Y247 PolarHBondContact O-N 3.4Å; A244-Y247 VanDerWaalsContact O-N 3.14Å; A244-G248 PolarHBondContact O-N 2.81Å; A244-L249 HydrophobicContact CB-CB 3.97Å; A244-L249 HydrophobicContact CB-CD2 3.67Å; A244-L249 HydrophobicContact CB-CG 4.48Å; A244-L249 WeakPolarHBondContact O-CB 3.34Å; A244-L249 PolarHBondContact O-N 3.5Å; A244-L249 VanDerWaalsContact O-N 3.11Å
245	S	87.9	Confident	91.7	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.014	11%	0.109	C	C	.	.	H	α-helix	trans	-58.3	-30.6	172.6	-175.7	0	0	0	0	112.8	A241 R242 I243 Y247 G248 L252 R260	A241-S245 PolarHBondContact O-N 3.49Å; R242-S245 WeakPolarHBondContact O-CB 3.31Å; R242-S245 PolarHBondContact O-N 3.06Å; I243-S245 VanDerWaalsContact C-N 3.26Å; I243-S245 PolarHBondContact O-N 3.14Å; S245-Y247 VanDerWaalsContact C-N 3.3Å; S245-Y247 PolarHBondContact O-N 3.15Å; S245-G248 PolarHBondContact O-N 2.8Å; S245-L252 WeakPolarHBondContact OG-CD1 3.42Å; S245-R260 PolarHBondContact OG-NH1 3.22Å
246	R	82.8	Confident	91.7	Very high	55 Å²	55	18.5 Å²	18.5	21%	0.208	10%	0.096	C	C	.	.	H	α-helix	trans	-71.1	-26.1	179.5	-59.6	-173.1	-179	159.7	7.4	112.6	Y117 E118 S125 I243 A244	Y117-R246 PolarHBondContact O-NE 3.09Å; E118-R246 PolarHBondContact O-NE 3.36Å; E118-R246 PolarHBondContact O-NH2 3.49Å; S125-R246 PolarHBondContact OG-NH2 3.11Å; I243-R246 WeakPolarHBondContact O-CB 3.46Å; I243-R246 PolarHBondContact O-N 2.86Å; A244-R246 PolarHBondContact O-N 3.47Å
247	Y	85.1	Confident	91.6	Very high	31 Å²	31	23.2 Å²	23.2	12%	0.122	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	7	177.6	-58.2	-89.4	0	0	0	113.1	L89 L132 I243 A244 S245	L89-Y247 HydrophobicContact CD2-CD2 3.32Å; L89-Y247 HydrophobicContact CD2-CE2 3.88Å; L89-Y247 HydrophobicContact CD2-CG 3.73Å; L132-Y247 VanDerWaalsContact CB-OH 3.24Å; L132-Y247 WeakPolarHBondContact CB-OH 3.41Å; L132-Y247 PolarHBondContact O-OH 3.26Å; I243-Y247 HydrophobicContact CG2-CE2 4.04Å; I243-Y247 VanDerWaalsContact O-CD2 3.28Å; I243-Y247 WeakPolarHBondContact O-CD2 3.39Å; A244-Y247 PolarHBondContact O-N 3.4Å; A244-Y247 VanDerWaalsContact O-N 3.14Å; S245-Y247 VanDerWaalsContact C-N 3.3Å; S245-Y247 PolarHBondContact O-N 3.15Å
248	G	86.1	Confident	91.4	Very high	27 Å²	27	23.4 Å²	23.4	28%	0.278	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.2	13.5	173	0	0	0	0	0	116.1	A244 S245 T250	A244-G248 PolarHBondContact O-N 2.81Å; S245-G248 PolarHBondContact O-N 2.8Å; G248-T250 PolarHBondContact O-N 2.78Å; G248-T250 VanDerWaalsContact O-N 3.1Å
249	L	90.6	Very high	91.3	Very high	4 Å²	4	23.1 Å²	23.1	2%	0.021	11%	0.114	C	C	.	.			trans	-60.3	116.3	169.8	-179.2	60.1	0	0	0	110.5	W48 Y52 L84 I88 A244 L252	W48-L249 HydrophobicContact CZ2-CD2 4.23Å; Y52-L249 HydrophobicContact CD2-CD1 4.45Å; Y52-L249 HydrophobicContact CE2-CD1 3.63Å; L84-L249 HydrophobicContact CD2-CD2 3.84Å; I88-L249 HydrophobicContact CD1-CB 4.37Å; I88-L249 HydrophobicContact CD1-CD1 4.06Å; I88-L249 HydrophobicContact CG1-CD1 4.31Å; I88-L249 HydrophobicContact CG2-CB 4.17Å; A244-L249 HydrophobicContact CB-CB 3.97Å; A244-L249 HydrophobicContact CB-CD2 3.67Å; A244-L249 HydrophobicContact CB-CG 4.48Å; A244-L249 WeakPolarHBondContact O-CB 3.34Å; A244-L249 PolarHBondContact O-N 3.5Å; A244-L249 VanDerWaalsContact O-N 3.11Å; L249-L252 HydrophobicContact CB-CD2 4.14Å; L249-L252 HydrophobicContact CD2-CD2 3.64Å; L249-L252 HydrophobicContact CG-CD2 3.77Å; L249-L252 HydrophobicContact CG-CG 4.27Å; L249-L252 WeakPolarHBondContact O-CG 3.4Å
250	T	90.5	Very high	91.1	Very high	112 Å²	112	25.5 Å²	25.5	69%	0.687	12%	0.123	S	C	*	.			trans	-91.1	-42	178.3	48.6	0	0	0	0	112.3	G248 L252	G248-T250 PolarHBondContact O-N 2.78Å; G248-T250 VanDerWaalsContact O-N 3.1Å; T250-L252 VanDerWaalsContact C-N 3.33Å; T250-L252 PolarHBondContact O-N 3.41Å
251	D	92.1	Very high	90.9	Very high	38 Å²	38	28.7 Å²	28.7	20%	0.203	14%	0.137	C	C	.	.	S	Bend	trans	-79.1	80.2	175.6	-172.2	30.8	0	0	0	111	W48 H51 Y52 R257	W48-D251 PolarHBondContact NE1-O 2.69Å; H51-D251 IonicContact CE1-OD1 2.93Å; H51-D251 IonicContact CE1-OD2 3.59Å; H51-D251 PolarHBondContact CE1-OD2 3.45Å; H51-D251 IonicContact ND1-OD1 3.57Å; H51-D251 IonicContact ND1-OD2 3.68Å; H51-D251 PolarHBondContact ND1-OD2 3.24Å; Y52-D251 HydrophobicContact CD2-CB 4.3Å; D251-R257 IonicContact OD1-NH2 2.78Å
252	L	93.7	Very high	90.8	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.137	C	C	.	.			trans	-98.7	156.8	179.1	-66.6	166.7	0	0	0	111.3	A241 S245 L249 T250 Y254 V256 R257	A241-L252 HydrophobicContact CB-CD2 4.48Å; A241-L252 WeakPolarHBondContact O-CD2 3.36Å; S245-L252 WeakPolarHBondContact OG-CD1 3.42Å; L249-L252 HydrophobicContact CB-CD2 4.14Å; L249-L252 HydrophobicContact CD2-CD2 3.64Å; L249-L252 HydrophobicContact CG-CD2 3.77Å; L249-L252 HydrophobicContact CG-CG 4.27Å; L249-L252 WeakPolarHBondContact O-CG 3.4Å; T250-L252 VanDerWaalsContact C-N 3.33Å; T250-L252 PolarHBondContact O-N 3.41Å; L252-Y254 PolarHBondContact O-N 2.96Å; L252-V256 HydrophobicContact CB-CB 4.4Å; L252-V256 HydrophobicContact CD1-CG1 4.3Å; L252-V256 HydrophobicContact CD2-CG1 4.28Å; L252-R257 PolarHBondContact O-NH2 3.08Å
253	P	95.8	Very high	90.7	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	14%	0.141	C	C	.	.			trans	-49.6	141.4	162.8	-17.2	26.8	0	0	0	109.9	D44 L45 W48 M238 A241 L255 V256 R257	D44-P253 WeakPolarHBondContact OD2-CB 3.24Å; L45-P253 HydrophobicContact CD2-CB 4.39Å; L45-P253 HydrophobicContact CD2-CG 3.95Å; W48-P253 HydrophobicContact CB-CB 4.29Å; W48-P253 HydrophobicContact CB-CG 4.3Å; W48-P253 HydrophobicContact CD2-CB 4.48Å; W48-P253 HydrophobicContact CD2-CG 3.57Å; W48-P253 HydrophobicContact CE3-CG 3.74Å; W48-P253 HydrophobicContact CG-CB 4.25Å; W48-P253 HydrophobicContact CG-CG 3.8Å; W48-P253 HydrophobicContact CZ2-CG 4.49Å; W48-P253 HydrophobicContact CZ3-CG 4.26Å; M238-P253 HydrophobicContact SD-CB 4.46Å; A241-P253 HydrophobicContact CB-CG 3.85Å; P253-L255 PolarHBondContact O-N 3.34Å; P253-V256 HydrophobicContact CB-CG2 4.13Å; P253-V256 HydrophobicContact CG-CG2 4Å; P253-V256 PolarHBondContact O-N 2.91Å; P253-R257 PolarHBondContact O-N 3.49Å
254	Y	95.8	Very high	90.6	Very high	96 Å²	96	32.6 Å²	32.6	38%	0.376	16%	0.156	S	C	.	.	H	α-helix	trans	-63.2	-31.7	-173.1	-169.8	-88.7	0	0	0	111.7	D44 L252 R257 M258 F531	D44-Y254 VanDerWaalsContact OD1-CB 3.31Å; D44-Y254 WeakPolarHBondContact OD1-CB 3.35Å; D44-Y254 PolarHBondContact OD1-N 3.04Å; D44-Y254 PolarHBondContact OD2-N 3.19Å; L252-Y254 PolarHBondContact O-N 2.96Å; Y254-R257 WeakPolarHBondContact O-CB 3.38Å; Y254-R257 PolarHBondContact O-N 3.4Å; Y254-M258 HydrophobicContact CD1-CE 3.83Å; Y254-M258 HydrophobicContact CD1-CG 4.04Å; Y254-M258 HydrophobicContact CD1-SD 3.96Å; Y254-M258 HydrophobicContact CE1-CE 3.93Å; Y254-M258 HydrophobicContact CE1-CG 3.71Å; Y254-M258 HydrophobicContact CE1-SD 3.45Å; Y254-M258 WeakPolarHBondContact CE1-SD 3.44Å; Y254-M258 WeakPolarHBondContact O-CG 3.43Å; Y254-M258 PolarHBondContact O-N 3.05Å; Y254-F531 AromaticContact CD1-CD2 3.22Å; Y254-F531 HydrophobicContact CD1-CD2 3.22Å; Y254-F531 AromaticContact CD1-CE2 3.44Å; Y254-F531 HydrophobicContact CD1-CE2 3.44Å; Y254-F531 VanDerWaalsContact CD1-CE2 3.44Å; Y254-F531 HydrophobicContact CD1-CG 4.18Å; Y254-F531 AromaticContact CE1-CD2 3.7Å; Y254-F531 HydrophobicContact CE1-CD2 3.7Å; Y254-F531 HydrophobicContact CE1-CE2 4.29Å; Y254-F531 AromaticContact CG-CD2 3.98Å; Y254-F531 HydrophobicContact CG-CD2 3.98Å; Y254-F531 AromaticContact CG-CE2 3.72Å; Y254-F531 HydrophobicContact CG-CE2 3.72Å
255	L	94.9	Very high	90.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.3	-49	171.8	-65.5	177.3	0	0	0	111.5	V41 D44 M238 P253 R257 M258 E259 F531 M536 W543	V41-L255 HydrophobicContact CB-CD1 4.13Å; V41-L255 HydrophobicContact CG2-CD1 3.53Å; D44-L255 HydrophobicContact CB-CD1 4.01Å; D44-L255 HydrophobicContact CB-CG 4.11Å; D44-L255 VanDerWaalsContact OD2-CB 3.26Å; D44-L255 WeakPolarHBondContact OD2-CB 3.47Å; D44-L255 VanDerWaalsContact OD2-CG 3.26Å; D44-L255 WeakPolarHBondContact OD2-CG 3.27Å; D44-L255 PolarHBondContact OD2-N 3.4Å; M238-L255 HydrophobicContact CE-CB 3.84Å; P253-L255 PolarHBondContact O-N 3.34Å; L255-R257 VanDerWaalsContact C-N 3.29Å; L255-R257 PolarHBondContact O-N 2.78Å; L255-M258 HydrophobicContact CD2-CE 3.63Å; L255-M258 PolarHBondContact O-N 2.8Å; L255-E259 WeakPolarHBondContact O-CG 3.45Å; L255-E259 PolarHBondContact O-N 2.94Å; L255-F531 HydrophobicContact CD2-CD1 3.87Å; L255-F531 HydrophobicContact CD2-CE1 4.19Å; L255-F531 HydrophobicContact CD2-CG 4.33Å; L255-F531 HydrophobicContact CG-CD1 4.44Å; L255-F531 HydrophobicContact CG-CE1 4.26Å; L255-M536 HydrophobicContact CD2-CE 4.46Å; L255-M536 HydrophobicContact CD2-CG 4.31Å; L255-W543 HydrophobicContact CD2-CD2 4.35Å; L255-W543 HydrophobicContact CD2-CG 4.3Å; L255-W543 WeakPolarHBondContact O-CZ2 3.21Å; L255-W543 PolarHBondContact O-NE1 3.46Å
256	V	93.9	Very high	90.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.2	-33.8	177.2	-176	0	0	0	0	111.5	L120 M238 A241 R242 L252 P253 E259 R260	L120-V256 HydrophobicContact CD1-CG1 4.45Å; M238-V256 HydrophobicContact CE-CG2 3.48Å; M238-V256 VanDerWaalsContact CE-CG2 3.48Å; M238-V256 HydrophobicContact SD-CG2 3.73Å; A241-V256 HydrophobicContact CB-CG2 4.29Å; R242-V256 HydrophobicContact CG-CG1 3.83Å; R242-V256 HydrophobicContact CG-CG2 4.3Å; L252-V256 HydrophobicContact CB-CB 4.4Å; L252-V256 HydrophobicContact CD1-CG1 4.3Å; L252-V256 HydrophobicContact CD2-CG1 4.28Å; P253-V256 HydrophobicContact CB-CG2 4.13Å; P253-V256 HydrophobicContact CG-CG2 4Å; P253-V256 PolarHBondContact O-N 2.91Å; V256-E259 WeakPolarHBondContact O-CB 3.47Å; V256-E259 PolarHBondContact O-N 3.11Å; V256-R260 PolarHBondContact O-N 2.97Å; V256-R260 VanDerWaalsContact O-N 3.15Å
257	R	93.4	Very high	90.5	Very high	100 Å²	100	36.3 Å²	36.3	38%	0.377	19%	0.188	S	C	.	.	H	α-helix	trans	-61.3	-43.6	174.4	-161.8	-177.1	-56.3	-178.4	0.9	111.6	D251 L252 P253 Y254 L255 R260 E261	D251-R257 IonicContact OD1-NH2 2.78Å; L252-R257 PolarHBondContact O-NH2 3.08Å; P253-R257 PolarHBondContact O-N 3.49Å; Y254-R257 WeakPolarHBondContact O-CB 3.38Å; Y254-R257 PolarHBondContact O-N 3.4Å; L255-R257 VanDerWaalsContact C-N 3.29Å; L255-R257 PolarHBondContact O-N 2.78Å; R257-R260 PolarHBondContact O-N 2.99Å; R257-E261 PolarHBondContact O-N 3.42Å; R257-E261 VanDerWaalsContact O-N 3.16Å
258	M	92.5	Very high	90.7	Very high	4 Å²	4	40.4 Å²	40.4	2%	0.02	21%	0.206	C	C	.	.	H	α-helix	trans	-70.7	-29.6	173	-70.2	-171.5	-59.8	0	0	113.4	Y254 L255 R260 E261 I262 R529 F531 W543	Y254-M258 HydrophobicContact CD1-CE 3.83Å; Y254-M258 HydrophobicContact CD1-CG 4.04Å; Y254-M258 HydrophobicContact CD1-SD 3.96Å; Y254-M258 HydrophobicContact CE1-CE 3.93Å; Y254-M258 HydrophobicContact CE1-CG 3.71Å; Y254-M258 HydrophobicContact CE1-SD 3.45Å; Y254-M258 WeakPolarHBondContact CE1-SD 3.44Å; Y254-M258 WeakPolarHBondContact O-CG 3.43Å; Y254-M258 PolarHBondContact O-N 3.05Å; L255-M258 HydrophobicContact CD2-CE 3.63Å; L255-M258 PolarHBondContact O-N 2.8Å; M258-R260 VanDerWaalsContact C-N 3.34Å; M258-E261 PolarHBondContact O-N 3.05Å; M258-I262 WeakPolarHBondContact O-CB 3.15Å; M258-I262 WeakPolarHBondContact O-CG1 3.24Å; M258-I262 PolarHBondContact O-N 3.3Å; M258-R529 HydrophobicContact CE-CB 4.44Å; M258-R529 HydrophobicContact SD-CB 3.38Å; M258-R529 WeakPolarHBondContact SD-CB 3.48Å; M258-R529 HydrophobicContact SD-CG 3.91Å; M258-F531 HydrophobicContact CE-CB 4.18Å; M258-W543 HydrophobicContact CB-CH2 3.73Å; M258-W543 HydrophobicContact CB-CZ2 3.65Å; M258-W543 HydrophobicContact CE-CH2 3.94Å; M258-W543 HydrophobicContact CE-CZ2 4.09Å; M258-W543 HydrophobicContact CE-CZ3 4.43Å; M258-W543 HydrophobicContact SD-CH2 4.44Å
259	E	92.4	Very high	90.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.3	-49.2	172.6	-65.8	-177.8	163	0	0	109.8	R242 L255 V256 E261 I262 D263 W543	R242-E259 IonicContact CZ-OE1 3.12Å; R242-E259 IonicContact CZ-OE2 3.76Å; R242-E259 IonicContact NE-OE1 2.68Å; R242-E259 IonicContact NE-OE2 2.78Å; R242-E259 PolarHBondContact NE-OE2 3.09Å; R242-E259 IonicContact NH2-OE1 3.85Å; R242-E259 PolarHBondContact NH2-OE1 2.88Å; R242-E259 IonicContact NH2-OE2 3.97Å; R242-E259 PolarHBondContact NH2-OE2 2.8Å; L255-E259 WeakPolarHBondContact O-CG 3.45Å; L255-E259 PolarHBondContact O-N 2.94Å; V256-E259 WeakPolarHBondContact O-CB 3.47Å; V256-E259 PolarHBondContact O-N 3.11Å; E259-E261 PolarHBondContact O-N 3.19Å; E259-I262 PolarHBondContact O-N 3.32Å; E259-D263 WeakPolarHBondContact O-CB 3.08Å; E259-D263 PolarHBondContact O-N 2.96Å; E259-W543 HydrophobicContact CG-CZ2 3.73Å; E259-W543 VanDerWaalsContact CG-NE1 3.28Å; E259-W543 PolarHBondContact OE1-NE1 3.38Å
260	R	87.7	Confident	90.2	Very high	50 Å²	50	45.6 Å²	45.6	19%	0.189	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-38.8	178	-165.8	175.7	70.7	-154.8	-1.8	113.1	Y117 L120 S245 V256 R257 M258 D263 E264	Y117-R260 HydrophobicContact CD1-CG 3.88Å; Y117-R260 HydrophobicContact CE1-CG 3.63Å; L120-R260 HydrophobicContact CD2-CB 3.76Å; L120-R260 HydrophobicContact CD2-CG 3.99Å; S245-R260 PolarHBondContact OG-NH1 3.22Å; V256-R260 PolarHBondContact O-N 2.97Å; V256-R260 VanDerWaalsContact O-N 3.15Å; R257-R260 PolarHBondContact O-N 2.99Å; M258-R260 VanDerWaalsContact C-N 3.34Å; R260-D263 PolarHBondContact O-N 2.89Å; R260-E264 WeakPolarHBondContact O-CB 3.31Å; R260-E264 WeakPolarHBondContact O-CG 3.47Å; R260-E264 PolarHBondContact O-N 2.63Å
261	E	90.9	Very high	89.8	Confident	70 Å²	70	45.3 Å²	45.3	33%	0.327	22%	0.223	S	C	.	.	H	α-helix	trans	-62	-45.5	174.8	-171	-143.3	128	0	0	111.9	R257 M258 E259 E264 L265 R529	R257-E261 PolarHBondContact O-N 3.42Å; R257-E261 VanDerWaalsContact O-N 3.16Å; M258-E261 PolarHBondContact O-N 3.05Å; E259-E261 PolarHBondContact O-N 3.19Å; E261-E264 PolarHBondContact O-N 2.99Å; E261-L265 WeakPolarHBondContact O-CG 3.4Å; E261-L265 PolarHBondContact O-N 3.21Å; E261-L265 VanDerWaalsContact O-N 3.14Å; E261-R529 IonicContact OE1-CZ 3.22Å; E261-R529 IonicContact OE1-NE 3.09Å; E261-R529 PolarHBondContact OE1-NE 2.83Å; E261-R529 IonicContact OE1-NH2 3.32Å; E261-R529 PolarHBondContact OE1-NH2 2.83Å; E261-R529 IonicContact OE2-NE 2.69Å
262	I	91.2	Very high	89.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.9	-43	177.8	-70.6	165.4	0	0	0	110.9	M258 E259 E264 L265 E266 Y527 R529 R538 W543	M258-I262 WeakPolarHBondContact O-CB 3.15Å; M258-I262 WeakPolarHBondContact O-CG1 3.24Å; M258-I262 PolarHBondContact O-N 3.3Å; E259-I262 PolarHBondContact O-N 3.32Å; I262-E264 VanDerWaalsContact C-N 3.33Å; I262-E264 PolarHBondContact O-N 3.08Å; I262-L265 CarbonylContact O-C 3.55Å; I262-L265 WeakPolarHBondContact O-CB 3.31Å; I262-L265 PolarHBondContact O-N 3.23Å; I262-L265 VanDerWaalsContact O-N 3.08Å; I262-E266 HydrophobicContact CG2-CG 4.37Å; I262-E266 PolarHBondContact O-N 2.94Å; I262-Y527 HydrophobicContact CG1-CG 4.48Å; I262-Y527 HydrophobicContact CG2-CD1 4.11Å; I262-Y527 HydrophobicContact CG2-CD2 3.73Å; I262-Y527 HydrophobicContact CG2-CE2 4.38Å; I262-Y527 HydrophobicContact CG2-CG 3.58Å; I262-R529 HydrophobicContact CD1-CG 4.11Å; I262-R538 HydrophobicContact CD1-CB 3.94Å; I262-R538 HydrophobicContact CD1-CG 4.06Å; I262-R538 HydrophobicContact CG2-CG 4.33Å; I262-W543 HydrophobicContact CD1-CH2 3.49Å; I262-W543 VanDerWaalsContact CD1-CH2 3.49Å; I262-W543 HydrophobicContact CD1-CZ2 4.31Å; I262-W543 HydrophobicContact CD1-CZ3 4.15Å
263	D	88.1	Confident	88.8	Confident	21 Å²	21	53.4 Å²	53.4	11%	0.112	26%	0.262	C	S	.	.	H	α-helix	trans	-67.5	-34.4	-179.5	-62.3	-24.3	0	0	0	111.1	L120 R121 E259 R260 L265 A267 R538	L120-D263 WeakPolarHBondContact CA-OD2 2.96Å; R121-D263 VanDerWaalsContact CB-OD1 3.25Å; R121-D263 WeakPolarHBondContact CB-OD1 3.33Å; R121-D263 PolarHBondContact N-OD2 3.26Å; E259-D263 WeakPolarHBondContact O-CB 3.08Å; E259-D263 PolarHBondContact O-N 2.96Å; R260-D263 PolarHBondContact O-N 2.89Å; D263-L265 VanDerWaalsContact C-N 3.33Å; D263-L265 PolarHBondContact O-N 2.95Å; D263-A267 WeakPolarHBondContact O-CB 3.23Å; D263-A267 PolarHBondContact O-N 2.91Å; D263-A267 VanDerWaalsContact O-N 3.08Å; D263-R538 IonicContact OD1-NH2 3.64Å
264	E	87.3	Confident	88	Confident	72 Å²	72	55.4 Å²	55.4	34%	0.336	28%	0.276	S	S	.	.	H	α-helix	trans	-65.3	-30.4	169.4	-78.3	-175.6	-164.3	0	0	113.1	Y117 R260 E261 I262 K268	Y117-E264 HydrophobicContact CE1-CG 4.27Å; Y117-E264 WeakPolarHBondContact CE1-OE1 3.39Å; Y117-E264 PolarHBondContact OH-OE1 2.93Å; R260-E264 WeakPolarHBondContact O-CB 3.31Å; R260-E264 WeakPolarHBondContact O-CG 3.47Å; R260-E264 PolarHBondContact O-N 2.63Å; E261-E264 PolarHBondContact O-N 2.99Å; I262-E264 VanDerWaalsContact C-N 3.33Å; I262-E264 PolarHBondContact O-N 3.08Å; E264-K268 WeakPolarHBondContact O-CG 3.27Å; E264-K268 PolarHBondContact O-N 3.2Å
265	L	87.6	Confident	87.4	Confident	39 Å²	39	54.2 Å²	54.2	20%	0.204	28%	0.276	C	S	.	.	H	α-helix	trans	-79.3	-40.8	174.4	-71	168.6	0	0	0	112.3	E261 I262 D263 A267 K268 H269	E261-L265 WeakPolarHBondContact O-CG 3.4Å; E261-L265 PolarHBondContact O-N 3.21Å; E261-L265 VanDerWaalsContact O-N 3.14Å; I262-L265 CarbonylContact O-C 3.55Å; I262-L265 WeakPolarHBondContact O-CB 3.31Å; I262-L265 PolarHBondContact O-N 3.23Å; I262-L265 VanDerWaalsContact O-N 3.08Å; D263-L265 VanDerWaalsContact C-N 3.33Å; D263-L265 PolarHBondContact O-N 2.95Å; L265-A267 VanDerWaalsContact C-N 3.27Å; L265-A267 PolarHBondContact O-N 3.27Å; L265-K268 PolarHBondContact O-N 3.09Å; L265-H269 PolarHBondContact O-CD2 3.15Å; L265-H269 PolarHBondContact O-N 2.92Å; L265-H269 VanDerWaalsContact O-N 3.09Å
266	E	86	Confident	86.6	Confident	34 Å²	34	58.9 Å²	58.9	16%	0.159	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-39.5	174.1	-76.4	-164	162.4	0	0	111.8	R121 I262 S270 Y527	R121-E266 WeakPolarHBondContact CD-OE2 3.38Å; R121-E266 IonicContact CZ-OE2 3.34Å; R121-E266 VanDerWaalsContact CZ-OE2 3.26Å; R121-E266 IonicContact NE-OE2 2.69Å; R121-E266 PolarHBondContact NE-OE2 3Å; R121-E266 IonicContact NH1-OE1 3.7Å; R121-E266 PolarHBondContact NH1-OE1 2.73Å; R121-E266 IonicContact NH1-OE2 2.71Å; R121-E266 PolarHBondContact NH1-OE2 3.36Å; I262-E266 HydrophobicContact CG2-CG 4.37Å; I262-E266 PolarHBondContact O-N 2.94Å; E266-S270 WeakPolarHBondContact O-CB 3.28Å; E266-S270 PolarHBondContact O-N 2.86Å; E266-S270 VanDerWaalsContact O-N 3.07Å; E266-S270 PolarHBondContact O-OG 3.49Å; E266-Y527 HydrophobicContact CG-CD2 4.32Å; E266-Y527 HydrophobicContact CG-CE2 3.5Å; E266-Y527 WeakPolarHBondContact OE1-CE2 3.29Å
267	A	85.9	Confident	85.8	Confident	63 Å²	63	63.3 Å²	63.3	52%	0.521	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-49.1	175	0	0	0	0	0	112.3	D263 L265 S270 Q271	D263-A267 WeakPolarHBondContact O-CB 3.23Å; D263-A267 PolarHBondContact O-N 2.91Å; D263-A267 VanDerWaalsContact O-N 3.08Å; L265-A267 VanDerWaalsContact C-N 3.27Å; L265-A267 PolarHBondContact O-N 3.27Å; A267-S270 WeakPolarHBondContact O-CB 3.26Å; A267-S270 PolarHBondContact O-N 3.1Å; A267-Q271 PolarHBondContact O-N 3.11Å; A267-Q271 VanDerWaalsContact O-N 3.13Å
268	K	87.4	Confident	85	Confident	118 Å²	118	64.3 Å²	64.3	51%	0.513	33%	0.332	S	S	.	.	H	α-helix	trans	-57.8	-52.6	178.5	-72.5	168.5	-175	172.3	0	111.8	E264 L265 S270 Q271 D272	E264-K268 WeakPolarHBondContact O-CG 3.27Å; E264-K268 PolarHBondContact O-N 3.2Å; L265-K268 PolarHBondContact O-N 3.09Å; K268-S270 PolarHBondContact O-N 3.2Å; K268-Q271 CarbonylContact O-C 3.59Å; K268-Q271 WeakPolarHBondContact O-CA 3.37Å; K268-Q271 VanDerWaalsContact O-CB 3.32Å; K268-Q271 WeakPolarHBondContact O-CB 3.19Å; K268-Q271 PolarHBondContact O-N 2.76Å; K268-D272 VanDerWaalsContact O-CG 3.23Å; K268-D272 PolarHBondContact O-N 2.95Å; K268-D272 VanDerWaalsContact O-OD2 3.12Å
269	H	85.3	Confident	84.1	Confident	59 Å²	59	69.7 Å²	69.7	27%	0.273	36%	0.36	S	S	.	.	H	α-helix	trans	-69.9	-19.5	-177.3	-71.7	-111.5	0	0	0	113.4	L265 D272 Q273 E515 R518	L265-H269 PolarHBondContact O-CD2 3.15Å; L265-H269 PolarHBondContact O-N 2.92Å; L265-H269 VanDerWaalsContact O-N 3.09Å; H269-D272 WeakPolarHBondContact CA-OD2 3.43Å; H269-D272 IonicContact CG-OD2 2.88Å; H269-Q273 VanDerWaalsContact O-CB 3.27Å; H269-Q273 WeakPolarHBondContact O-CB 3.22Å; H269-Q273 PolarHBondContact O-N 2.65Å; H269-E515 IonicContact CE1-OE1 2.73Å; H269-E515 IonicContact CE1-OE2 3.57Å; H269-E515 PolarHBondContact CE1-OE2 3.39Å; H269-E515 IonicContact ND1-OE2 3.76Å; H269-E515 IonicContact NE2-OE2 3.92Å; H269-R518 PolarHBondContact CD2-NH2 3.43Å; H269-R518 PolarHBondContact CE1-NH2 2.88Å; H269-R518 VanDerWaalsContact CG-NH1 3.28Å; H269-R518 PolarHBondContact ND1-NH1 3.35Å; H269-R518 PolarHBondContact ND1-NH2 2.77Å; H269-R518 VanDerWaalsContact ND1-NH2 3.19Å; H269-R518 PolarHBondContact NE2-NH2 3.36Å
270	S	82.2	Confident	83	Confident	81 Å²	81	77.3 Å²	77.3	57%	0.566	39%	0.391	S	S	*	.	H	α-helix	trans	-71	-39.5	168.6	-57.2	0	0	0	0	111.2	E266 A267 K268 S274	E266-S270 WeakPolarHBondContact O-CB 3.28Å; E266-S270 PolarHBondContact O-N 2.86Å; E266-S270 VanDerWaalsContact O-N 3.07Å; E266-S270 PolarHBondContact O-OG 3.49Å; A267-S270 WeakPolarHBondContact O-CB 3.26Å; A267-S270 PolarHBondContact O-N 3.1Å; K268-S270 PolarHBondContact O-N 3.2Å; S270-S274 PolarHBondContact O-N 3.36Å; S270-S274 VanDerWaalsContact O-N 3.1Å; S270-S274 PolarHBondContact O-OG 3.35Å
271	Q	81.6	Confident	81.8	Confident	106 Å²	106	80.8 Å²	80.8	50%	0.495	41%	0.408	S	S	.	.	H	α-helix	trans	-67.8	-49.5	174.2	-172	66.5	52.6	0	0	111.4	A267 K268 Q273 S274 D275	A267-Q271 PolarHBondContact O-N 3.11Å; A267-Q271 VanDerWaalsContact O-N 3.13Å; K268-Q271 CarbonylContact O-C 3.59Å; K268-Q271 WeakPolarHBondContact O-CA 3.37Å; K268-Q271 VanDerWaalsContact O-CB 3.32Å; K268-Q271 WeakPolarHBondContact O-CB 3.19Å; K268-Q271 PolarHBondContact O-N 2.76Å; Q271-Q273 PolarHBondContact O-N 3.08Å; Q271-S274 WeakPolarHBondContact CA-OG 3.37Å; Q271-S274 PolarHBondContact NE2-OG 2.94Å; Q271-S274 PolarHBondContact O-N 3.19Å; Q271-S274 PolarHBondContact O-OG 3.19Å; Q271-D275 PolarHBondContact NE2-OD1 3.48Å; Q271-D275 PolarHBondContact O-N 3.26Å
272	D	84	Confident	80.5	Confident	78 Å²	78	81.5 Å²	81.5	42%	0.417	42%	0.415	S	S	.	.	H	α-helix	trans	-55.1	-40	178	-55.8	-41.2	0	0	0	110.9	K268 H269 D275 I276	K268-D272 VanDerWaalsContact O-CG 3.23Å; K268-D272 PolarHBondContact O-N 2.95Å; K268-D272 VanDerWaalsContact O-OD2 3.12Å; H269-D272 WeakPolarHBondContact CA-OD2 3.43Å; H269-D272 IonicContact CG-OD2 2.88Å; D272-D275 PolarHBondContact O-N 3.34Å; D272-I276 WeakPolarHBondContact O-CB 3.35Å; D272-I276 WeakPolarHBondContact O-CD1 3.41Å; D272-I276 VanDerWaalsContact O-CG1 3.23Å; D272-I276 WeakPolarHBondContact O-CG1 3.3Å; D272-I276 PolarHBondContact O-N 3.49Å
273	Q	81	Confident	78.9	Confident	130 Å²	130	85.8 Å²	85.8	61%	0.607	44%	0.438	S	S	*	.	H	α-helix	trans	-74.4	-30.2	178.3	-171.1	151.9	36.8	0	0	113.4	H269 Q271 N277	H269-Q273 VanDerWaalsContact O-CB 3.27Å; H269-Q273 WeakPolarHBondContact O-CB 3.22Å; H269-Q273 PolarHBondContact O-N 2.65Å; Q271-Q273 PolarHBondContact O-N 3.08Å; Q273-N277 WeakPolarHBondContact O-CB 3.46Å; Q273-N277 PolarHBondContact O-N 3.39Å; Q273-N277 PolarHBondContact O-ND2 2.98Å
274	S	79.4	Confident	77.4	Confident	43 Å²	43	89 Å²	89	30%	0.301	46%	0.455	S	S	.	.	H	α-helix	trans	-70.4	-37.9	169.3	52	0	0	0	0	112.4	S270 Q271 N277 H278	S270-S274 PolarHBondContact O-N 3.36Å; S270-S274 VanDerWaalsContact O-N 3.1Å; S270-S274 PolarHBondContact O-OG 3.35Å; Q271-S274 WeakPolarHBondContact CA-OG 3.37Å; Q271-S274 PolarHBondContact NE2-OG 2.94Å; Q271-S274 PolarHBondContact O-N 3.19Å; Q271-S274 PolarHBondContact O-OG 3.19Å; S274-N277 PolarHBondContact O-N 3.06Å; S274-H278 PolarHBondContact O-CD2 3.41Å; S274-H278 PolarHBondContact O-N 3.1Å
275	D	82.2	Confident	76	Confident	71 Å²	71	89.2 Å²	89.2	38%	0.38	46%	0.458	S	S	.	.	H	α-helix	trans	-70.2	-40.5	-177	-64.2	-4.6	0	0	0	110.9	Q271 D272 H278 L279	Q271-D275 PolarHBondContact NE2-OD1 3.48Å; Q271-D275 PolarHBondContact O-N 3.26Å; D272-D275 PolarHBondContact O-N 3.34Å; D275-H278 PolarHBondContact O-N 2.9Å; D275-L279 WeakPolarHBondContact O-CD1 3.45Å; D275-L279 PolarHBondContact O-N 2.91Å
276	I	79.7	Confident	74.4	Confident	97 Å²	97	92 Å²	92	50%	0.497	47%	0.473	S	S	.	.	H	α-helix	trans	-60.2	-44.8	170.3	-70.1	167.6	0	0	0	111.2	D272 H278 L279 Y280	D272-I276 WeakPolarHBondContact O-CB 3.35Å; D272-I276 WeakPolarHBondContact O-CD1 3.41Å; D272-I276 VanDerWaalsContact O-CG1 3.23Å; D272-I276 WeakPolarHBondContact O-CG1 3.3Å; D272-I276 PolarHBondContact O-N 3.49Å; I276-H278 VanDerWaalsContact C-N 3.33Å; I276-H278 PolarHBondContact O-N 2.96Å; I276-L279 PolarHBondContact O-N 3.11Å; I276-Y280 HydrophobicContact CG2-CD2 3.87Å; I276-Y280 HydrophobicContact CG2-CE2 3.63Å; I276-Y280 VanDerWaalsContact O-CD2 3.24Å; I276-Y280 WeakPolarHBondContact O-CD2 3.44Å; I276-Y280 PolarHBondContact O-N 2.72Å; I276-Y280 VanDerWaalsContact O-N 3.11Å
277	N	76.1	Confident	72.9	Confident	94 Å²	94	94.4 Å²	94.4	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-63.8	-38	178.2	-74.3	-23.6	0	0	0	112	Q273 S274 Y280 H281	Q273-N277 WeakPolarHBondContact O-CB 3.46Å; Q273-N277 PolarHBondContact O-N 3.39Å; Q273-N277 PolarHBondContact O-ND2 2.98Å; S274-N277 PolarHBondContact O-N 3.06Å; N277-Y280 PolarHBondContact O-N 3.19Å; N277-H281 PolarHBondContact O-N 3.03Å; N277-H281 VanDerWaalsContact O-N 3.08Å
278	H	76.7	Confident	71.3	Confident	120 Å²	120	96.2 Å²	96.2	56%	0.556	49%	0.487	S	S	*	.	H	α-helix	trans	-62.7	-46.6	172.7	-95.7	-78.4	0	0	0	112	S274 D275 I276 Y280 H281 D282	S274-H278 PolarHBondContact O-CD2 3.41Å; S274-H278 PolarHBondContact O-N 3.1Å; D275-H278 PolarHBondContact O-N 2.9Å; I276-H278 VanDerWaalsContact C-N 3.33Å; I276-H278 PolarHBondContact O-N 2.96Å; H278-Y280 VanDerWaalsContact C-N 3.29Å; H278-Y280 PolarHBondContact O-N 3.49Å; H278-H281 PolarHBondContact O-N 2.89Å; H278-D282 PolarHBondContact O-N 3.41Å
279	L	74.3	Confident	69.6	Low	117 Å²	117	96.5 Å²	96.5	61%	0.613	49%	0.494	S	S	*	.	H	α-helix	trans	-56.8	-40.3	176	-101.2	80.8	0	0	0	112.7	D275 I276 N283	D275-L279 WeakPolarHBondContact O-CD1 3.45Å; D275-L279 PolarHBondContact O-N 2.91Å; I276-L279 PolarHBondContact O-N 3.11Å; L279-N283 WeakPolarHBondContact O-CB 3.27Å; L279-N283 PolarHBondContact O-N 2.68Å; L279-N283 VanDerWaalsContact O-N 3.16Å; L279-N283 PolarHBondContact O-ND2 3.43Å
280	Y	68.3	Low	67.8	Low	161 Å²	161	101.2 Å²	101.2	63%	0.631	52%	0.515	S	S	*	.	H	α-helix	trans	-67.5	-38.1	175.1	-78.5	-66.9	0	0	0	112.6	I276 N277 H278 N284	I276-Y280 HydrophobicContact CG2-CD2 3.87Å; I276-Y280 HydrophobicContact CG2-CE2 3.63Å; I276-Y280 VanDerWaalsContact O-CD2 3.24Å; I276-Y280 WeakPolarHBondContact O-CD2 3.44Å; I276-Y280 PolarHBondContact O-N 2.72Å; I276-Y280 VanDerWaalsContact O-N 3.11Å; N277-Y280 PolarHBondContact O-N 3.19Å; H278-Y280 VanDerWaalsContact C-N 3.29Å; H278-Y280 PolarHBondContact O-N 3.49Å; Y280-N284 PolarHBondContact O-N 3.47Å; Y280-N284 VanDerWaalsContact O-N 3.14Å; Y280-N284 PolarHBondContact O-ND2 2.94Å
281	H	62.5	Low	66.2	Low	122 Å²	122	100.3 Å²	100.3	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-72.3	-40.9	-178.7	-131.6	-50.6	0	0	0	113	N277 H278 N284 N285	N277-H281 PolarHBondContact O-N 3.03Å; N277-H281 VanDerWaalsContact O-N 3.08Å; H278-H281 PolarHBondContact O-N 2.89Å; H281-N284 PolarHBondContact O-N 2.88Å; H281-N285 WeakPolarHBondContact O-CB 3.27Å; H281-N285 PolarHBondContact O-N 3.35Å; H281-N285 PolarHBondContact O-ND2 2.95Å
282	D	62.9	Low	64.5	Low	86 Å²	86	100.4 Å²	100.4	46%	0.46	51%	0.513	S	S	.	.	H	α-helix	trans	-71.7	-33.8	178.7	-70.6	-28.2	0	0	0	112.1	H278 N285 N286	H278-D282 PolarHBondContact O-N 3.41Å; D282-N285 PolarHBondContact O-N 2.97Å; D282-N286 PolarHBondContact O-N 3.02Å
283	N	58.1	Low	62.7	Low	90 Å²	90	105.2 Å²	105.2	48%	0.481	53%	0.533	S	S	.	.	H	α-helix	trans	-62.9	-47.4	169.6	-82.4	-56.9	0	0	0	111.3	L279 N285 N286 I287	L279-N283 WeakPolarHBondContact O-CB 3.27Å; L279-N283 PolarHBondContact O-N 2.68Å; L279-N283 VanDerWaalsContact O-N 3.16Å; L279-N283 PolarHBondContact O-ND2 3.43Å; N283-N285 VanDerWaalsContact C-N 3.32Å; N283-N285 PolarHBondContact O-N 3.35Å; N283-N286 PolarHBondContact O-N 3.15Å; N283-I287 WeakPolarHBondContact O-CB 3.46Å; N283-I287 WeakPolarHBondContact O-CD1 3.3Å; N283-I287 WeakPolarHBondContact O-CG1 3.49Å; N283-I287 PolarHBondContact O-N 3.44Å
284	N	57.7	Low	61	Low	88 Å²	88	102.8 Å²	102.8	47%	0.471	54%	0.535	S	S	.	.	H	α-helix	trans	-61.6	-39.3	176.7	-75.2	-20.1	0	0	0	112.4	Y280 H281 N288	Y280-N284 PolarHBondContact O-N 3.47Å; Y280-N284 VanDerWaalsContact O-N 3.14Å; Y280-N284 PolarHBondContact O-ND2 2.94Å; H281-N284 PolarHBondContact O-N 2.88Å; N284-N288 WeakPolarHBondContact O-CB 2.99Å; N284-N288 PolarHBondContact O-N 2.92Å; N284-N288 PolarHBondContact O-ND2 2.88Å
285	N	56.5	Low	59.2	Low	77 Å²	77	106.1 Å²	106.1	41%	0.412	55%	0.554	S	S	.	*	H	α-helix	trans	-66.8	-39.1	177.3	-69.8	-22.9	0	0	0	112.6	H281 D282 N283 N289	H281-N285 WeakPolarHBondContact O-CB 3.27Å; H281-N285 PolarHBondContact O-N 3.35Å; H281-N285 PolarHBondContact O-ND2 2.95Å; D282-N285 PolarHBondContact O-N 2.97Å; N283-N285 VanDerWaalsContact C-N 3.32Å; N283-N285 PolarHBondContact O-N 3.35Å; N285-N289 PolarHBondContact O-N 3.5Å
286	N	54.7	Low	57.2	Low	97 Å²	97	109.5 Å²	109.5	52%	0.519	57%	0.57	S	S	.	*	H	α-helix	trans	-73.2	-38.9	174.5	-91	-44.1	0	0	0	113	D282 N283 N288 N289 F290	D282-N286 PolarHBondContact O-N 3.02Å; N283-N286 PolarHBondContact O-N 3.15Å; N286-N288 VanDerWaalsContact C-N 3.33Å; N286-N288 PolarHBondContact O-N 3.42Å; N286-N289 PolarHBondContact O-N 2.94Å; N286-N289 VanDerWaalsContact O-N 3.17Å; N286-F290 PolarHBondContact O-N 3.01Å; N286-F290 VanDerWaalsContact O-N 3.12Å
287	I	54.6	Low	55.2	Low	84 Å²	84	112.1 Å²	112.1	43%	0.431	59%	0.585	S	S	.	*	H	α-helix	trans	-57.7	-47.9	174.9	-73.4	166	0	0	0	109.4	N283 N289 F290 T291	N283-I287 WeakPolarHBondContact O-CB 3.46Å; N283-I287 WeakPolarHBondContact O-CD1 3.3Å; N283-I287 WeakPolarHBondContact O-CG1 3.49Å; N283-I287 PolarHBondContact O-N 3.44Å; I287-N289 PolarHBondContact O-N 3.24Å; I287-N289 VanDerWaalsContact O-N 3.14Å; I287-F290 PolarHBondContact O-N 3.43Å; I287-F290 VanDerWaalsContact O-N 3.11Å; I287-T291 WeakPolarHBondContact CG2-OG1 3.38Å; I287-T291 WeakPolarHBondContact O-CB 3.47Å; I287-T291 PolarHBondContact O-N 2.97Å; I287-T291 PolarHBondContact O-OG1 3.37Å
288	N	51.7	Low	53.5	Low	102 Å²	102	115.7 Å²	115.7	55%	0.545	60%	0.603	S	S	.	*	H	α-helix	trans	-61.7	-26	179.5	-68.5	-18.8	0	0	0	114.2	N284 N286 T292	N284-N288 WeakPolarHBondContact O-CB 2.99Å; N284-N288 PolarHBondContact O-N 2.92Å; N284-N288 PolarHBondContact O-ND2 2.88Å; N286-N288 VanDerWaalsContact C-N 3.33Å; N286-N288 PolarHBondContact O-N 3.42Å; N288-T292 PolarHBondContact O-OG1 3.38Å
289	N	51.4	Low	51.6	Low	123 Å²	123	118.1 Å²	118.1	66%	0.658	62%	0.615	S	S	*	*	H	α-helix	trans	-89.1	-15.4	177.6	-74.5	-17.8	0	0	0	114.6	N285 N286 I287	N285-N289 PolarHBondContact O-N 3.5Å; N286-N289 PolarHBondContact O-N 2.94Å; N286-N289 VanDerWaalsContact O-N 3.17Å; I287-N289 PolarHBondContact O-N 3.24Å; I287-N289 VanDerWaalsContact O-N 3.14Å
290	F	48.9	Very low	49.9	Very low	159 Å²	159	123.2 Å²	123.2	70%	0.697	63%	0.626	S	S	*	*	H	α-helix	trans	-105.9	-31.8	174.8	-87.1	-88.1	0	0	0	113.3	N286 I287 T292 H293	N286-F290 PolarHBondContact O-N 3.01Å; N286-F290 VanDerWaalsContact O-N 3.12Å; I287-F290 PolarHBondContact O-N 3.43Å; I287-F290 VanDerWaalsContact O-N 3.11Å; F290-T292 VanDerWaalsContact C-N 3.32Å; F290-T292 PolarHBondContact O-N 3Å; F290-H293 PolarHBondContact O-N 2.89Å
291	T	47.2	Very low	48.7	Very low	62 Å²	62	122.7 Å²	122.7	38%	0.38	63%	0.633	S	S	.	*	H	α-helix	trans	-69.3	-28.5	-177.1	-62.6	0	0	0	0	112.7	I287 H293 A294 V295	I287-T291 WeakPolarHBondContact CG2-OG1 3.38Å; I287-T291 WeakPolarHBondContact O-CB 3.47Å; I287-T291 PolarHBondContact O-N 2.97Å; I287-T291 PolarHBondContact O-OG1 3.37Å; T291-H293 PolarHBondContact O-N 3.3Å; T291-H293 VanDerWaalsContact O-N 3.16Å; T291-A294 PolarHBondContact O-N 2.89Å; T291-A294 VanDerWaalsContact O-N 3.08Å; T291-V295 HydrophobicContact CG2-CB 4.47Å; T291-V295 HydrophobicContact CG2-CG2 3.46Å; T291-V295 VanDerWaalsContact CG2-CG2 3.46Å; T291-V295 PolarHBondContact O-N 3.18Å
292	T	47.7	Very low	47.6	Very low	107 Å²	107	123.9 Å²	123.9	66%	0.656	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-15.1	176.8	29.8	0	0	0	0	114.7	N288 F290	N288-T292 PolarHBondContact O-OG1 3.38Å; F290-T292 VanDerWaalsContact C-N 3.32Å; F290-T292 PolarHBondContact O-N 3Å
293	H	45.5	Very low	46.2	Very low	180 Å²	180	127.8 Å²	127.8	83%	0.833	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	-0.1	172.6	-94.8	-75.7	0	0	0	114.5	F290 T291	F290-H293 PolarHBondContact O-N 2.89Å; T291-H293 PolarHBondContact O-N 3.3Å; T291-H293 VanDerWaalsContact O-N 3.16Å
294	A	45.3	Very low	45.4	Very low	79 Å²	79	131.4 Å²	131.4	65%	0.653	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	-19.9	-175.8	0	0	0	0	0	114.4	T291 I296	T291-A294 PolarHBondContact O-N 2.89Å; T291-A294 VanDerWaalsContact O-N 3.08Å; A294-I296 PolarHBondContact O-N 2.86Å
295	V	40.4	Very low	44.4	Very low	113 Å²	113	135.3 Å²	135.3	69%	0.685	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	78	-173.7	-174.7	0	0	0	0	111.4	T291	T291-V295 HydrophobicContact CG2-CB 4.47Å; T291-V295 HydrophobicContact CG2-CG2 3.46Å; T291-V295 VanDerWaalsContact CG2-CG2 3.46Å; T291-V295 PolarHBondContact O-N 3.18Å
296	I	41.9	Very low	43.5	Very low	141 Å²	141	137.1 Å²	137.1	72%	0.723	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131	-26.1	169.4	-66.4	-177	0	0	0	112.2	A294	A294-I296 PolarHBondContact O-N 2.86Å
297	N	36.7	Very low	42.5	Very low	152 Å²	152	139.4 Å²	139.4	81%	0.813	72%	0.717	S	S	*	*	S	Bend	trans	-115.8	54.6	-169.8	-72.6	-30.6	0	0	0	114.3
298	L	41.1	Very low	41.5	Very low	170 Å²	170	143 Å²	143	89%	0.89	74%	0.737	S	S	*	*			trans	-148.1	28.1	165.6	-143	70.9	0	0	0	115.4
299	E	36.9	Very low	40.6	Very low	171 Å²	171	143.7 Å²	143.7	80%	0.799	75%	0.748	S	S	*	*			trans	-99.3	86.8	166.9	-76.7	-161.2	154.4	0	0	111.8
300	R	37.8	Very low	39.7	Very low	224 Å²	224	146.5 Å²	146.5	85%	0.845	75%	0.754	S	S	*	*			trans	171.5	171.2	154.7	-95.3	152.5	-165.5	86.8	-6.2	108.7
301	I	43.9	Very low	39.1	Very low	150 Å²	150	144.5 Å²	144.5	77%	0.769	76%	0.76	S	S	*	*	S	Bend	trans	88.6	103.6	177.2	-53.1	176.6	0	0	0	113.9
302	D	39.3	Very low	38.4	Very low	147 Å²	147	149.5 Å²	149.5	79%	0.786	78%	0.783	S	S	*	*			trans	74	72.6	143.9	-55.5	-3.7	0	0	0	121.8	Q304	D302-Q304 PolarHBondContact O-N 2.7Å
303	N	32.7	Very low	37.7	Very low	168 Å²	168	149.2 Å²	149.2	90%	0.898	79%	0.785	S	S	*	*			trans	-67.6	89.1	138.1	-89.2	-47.8	0	0	0	110.6
304	Q	41.9	Very low	37.1	Very low	165 Å²	165	147.9 Å²	147.9	77%	0.771	78%	0.784	S	S	*	*			trans	-163.8	139.5	153.5	-119.2	172.7	87.1	0	0	116.9	D302	D302-Q304 PolarHBondContact O-N 2.7Å
305	K	37.4	Very low	36.4	Very low	171 Å²	171	151.5 Å²	151.5	74%	0.743	79%	0.792	S	S	*	*			trans	79.8	108.6	154.8	-69.4	-175.6	177.6	176.2	0	122.2
306	V	36.8	Very low	36.1	Very low	115 Å²	115	154.7 Å²	154.7	70%	0.697	80%	0.799	S	S	*	*				68.3	100.6	121.1	-177.2	0	0	0	0	118.6
307	D	33.1	Very low	35.8	Very low	145 Å²	145	155.2 Å²	155.2	78%	0.775	80%	0.802	S	S	*	*				30.4	101.7	122.4	-40.9	-43.7	0	0	0	119.3
308	N	34.4	Very low	35.6	Very low	160 Å²	160	153.2 Å²	153.2	86%	0.856	80%	0.795	S	S	*	*				-162.9	179.1	124.8	-135.2	-42.3	0	0	0	113.4
309	C	32.2	Very low	35.4	Very low	115 Å²	115	151.6 Å²	151.6	78%	0.777	79%	0.792	S	S	*	*			trans	72.9	89.1	167	-58.9	0	0	0	0	117.4
310	K	33.4	Very low	35.2	Very low	182 Å²	182	148.1 Å²	148.1	79%	0.791	78%	0.779	S	S	*	*			trans	-59.7	166.5	140.4	-67.1	179.6	177.1	179.9	0	109.7
311	S	34.7	Very low	34.9	Very low	118 Å²	118	146 Å²	146	83%	0.825	78%	0.776	S	S	*	*			trans	87.1	70.2	164.7	-47.7	0	0	0	0	118.6
312	I	33.5	Very low	34.4	Very low	166 Å²	166	150.9 Å²	150.9	85%	0.851	79%	0.785	S	S	*	*			trans	-129.5	108.6	139.7	-58.9	-178	0	0	0	109.5
313	S	32.5	Very low	34.1	Very low	101 Å²	101	153.6 Å²	153.6	71%	0.706	79%	0.79	S	S	*	*			trans	-120.5	164.2	149.5	57.8	0	0	0	0	107.6
314	N	33	Very low	34.3	Very low	152 Å²	152	152.7 Å²	152.7	81%	0.813	79%	0.79	S	S	*	*			trans	75.4	101.2	-169.5	-45.7	-26	0	0	0	113.9
315	L	32.1	Very low	33.8	Very low	156 Å²	156	154.7 Å²	154.7	82%	0.817	80%	0.796	S	S	*	*			trans	-136.5	93.9	157.3	-167.9	74.1	0	0	0	108.8	I317	L315-I317 PolarHBondContact O-N 2.45Å
316	E	34.1	Very low	33.7	Very low	180 Å²	180	151.9 Å²	151.9	84%	0.841	80%	0.798	S	S	*	*			trans	-72.6	119.8	172.4	-70.2	-176.8	110.5	0	0	110.2	T318	E316-T318 PolarHBondContact O-N 3.36Å
317	I	35.4	Very low	33.7	Very low	152 Å²	152	155.2 Å²	155.2	78%	0.779	81%	0.806	S	S	*	*			trans	-79.9	92.9	178.6	-59.2	-179.7	0	0	0	109.5	L315 V319	L315-I317 PolarHBondContact O-N 2.45Å; I317-V319 HydrophobicContact CG2-CG2 4.49Å; I317-V319 PolarHBondContact O-N 2.78Å; I317-V319 VanDerWaalsContact O-N 3.16Å
318	T	31.8	Very low	33.7	Very low	109 Å²	109	158.6 Å²	158.6	67%	0.669	81%	0.814	S	S	*	*			trans	-75.2	98	176	-61.9	0	0	0	0	111.5	E316 N320	E316-T318 PolarHBondContact O-N 3.36Å; T318-N320 PolarHBondContact O-ND2 2.85Å
319	V	36.5	Very low	33.6	Very low	137 Å²	137	156.5 Å²	156.5	83%	0.83	81%	0.811	S	S	*	*			trans	-72.3	130.8	171.7	-178.8	0	0	0	0	110.2	I317	I317-V319 HydrophobicContact CG2-CG2 4.49Å; I317-V319 PolarHBondContact O-N 2.78Å; I317-V319 VanDerWaalsContact O-N 3.16Å
320	N	32.2	Very low	33.8	Very low	98 Å²	98	156.5 Å²	156.5	52%	0.524	81%	0.813	S	S	.	*			trans	-106.6	134.7	-162.1	-112.7	-95.5	0	0	0	114.1	T318	T318-N320 PolarHBondContact O-ND2 2.85Å
321	K	32.5	Very low	34	Very low	178 Å²	178	157 Å²	157	77%	0.774	82%	0.815	S	S	*	*			trans	60.5	125	148.5	-64.3	157	-179.5	140.6	0	119.6
322	R	33.1	Very low	34.1	Very low	254 Å²	254	160.4 Å²	160.4	96%	0.958	82%	0.815	S	S	*	*				-144.1	150.4	119.6	-102.8	160.4	-159.9	-177.3	5.8	109.9
323	K	33.8	Very low	34.2	Very low	203 Å²	203	158.3 Å²	158.3	88%	0.883	81%	0.806	S	S	*	*			trans	-96.8	139.2	-173.7	-70.3	174.2	177.4	170.1	0	111.5
324	V	37.1	Very low	34.3	Very low	149 Å²	149	158.8 Å²	158.8	90%	0.903	81%	0.805	S	S	*	*			trans	-136	145.6	144.4	-177	0	0	0	0	108
325	K	31	Very low	34.5	Very low	208 Å²	208	158.9 Å²	158.9	90%	0.904	80%	0.803	S	S	*	*			trans	-120	124.9	-178.6	-102.7	-171.4	172.9	-173.7	0	110.7
326	S	35.2	Very low	34.8	Very low	112 Å²	112	155.5 Å²	155.5	78%	0.783	79%	0.793	S	S	*	*			trans	-168.3	105.2	150.7	-165.2	0	0	0	0	108
327	Q	35.4	Very low	35	Very low	184 Å²	184	153.3 Å²	153.3	86%	0.86	79%	0.787	S	S	*	*				55.5	88.4	80.1	-75.8	-162.4	-19.5	0	0	116.3
328	K	34.7	Very low	35.2	Very low	216 Å²	216	152.5 Å²	152.5	94%	0.939	79%	0.785	S	S	*	*				-165.5	170.2	116.7	-109.2	173.6	-179.2	179.2	0	112
329	S	31.7	Very low	35.6	Very low	116 Å²	116	154 Å²	154	81%	0.811	79%	0.788	S	S	*	*			trans	-150	132	-159	57.8	0	0	0	0	115
330	S	36.4	Very low	35.7	Very low	115 Å²	115	155.6 Å²	155.6	80%	0.804	79%	0.786	S	S	*	*			trans	-170.2	116.1	158.5	46.9	0	0	0	0	107.3
331	K	36.5	Very low	36.2	Very low	192 Å²	192	157.6 Å²	157.6	84%	0.835	79%	0.794	S	S	*	*				76	150.6	54.1	-84.4	-161.2	169.5	-171.1	0	115.2
332	F	38.1	Very low	36.5	Very low	190 Å²	190	154.9 Å²	154.9	83%	0.833	79%	0.788	S	S	*	*			trans	71.1	126.2	-173	-55	-92.3	0	0	0	113.4
333	N	36.2	Very low	36.8	Very low	122 Å²	122	150.3 Å²	150.3	65%	0.652	78%	0.775	S	S	*	*			cis	-146	162.5	-7.7	-89.9	-1	0	0	0	107.7
334	T	32.8	Very low	36.8	Very low	112 Å²	112	148.1 Å²	148.1	69%	0.687	77%	0.773	S	S	*	*			cis	84.6	145.2	13.2	71.7	0	0	0	0	118.4
335	I	37.8	Very low	36.7	Very low	153 Å²	153	144.9 Å²	144.9	79%	0.785	76%	0.757	S	S	*	*			trans	78.2	135.1	-179.5	-57.1	171.5	0	0	0	113.4
336	S	39	Very low	37	Very low	86 Å²	86	141.2 Å²	141.2	60%	0.601	75%	0.747	S	S	*	*			cis	179.2	167.1	-16.8	-88.3	0	0	0	0	106.6
337	D	37.6	Very low	37.1	Very low	134 Å²	134	141.3 Å²	141.3	72%	0.717	74%	0.739	S	S	*	*			cis	-164.9	-167.3	-25.7	-96	-42.3	0	0	0	107.2
338	D	40.7	Very low	37.1	Very low	135 Å²	135	140.8 Å²	140.8	72%	0.722	73%	0.734	S	S	*	*			trans	80.8	103	155.1	-68.8	-39.5	0	0	0	122.5
339	N	39.6	Very low	37.1	Very low	139 Å²	139	137.1 Å²	137.1	74%	0.743	73%	0.725	S	S	*	*				66.9	138.9	128.1	-49.2	-41.7	0	0	0	119.9
340	H	39.1	Very low	37	Very low	172 Å²	172	137.8 Å²	137.8	80%	0.796	72%	0.724	S	S	*	*			cis	-155.2	167.1	37.8	-160.7	-87.5	0	0	0	113.9
341	M	41.3	Very low	37	Very low	140 Å²	140	138.3 Å²	138.3	69%	0.69	72%	0.722	S	S	*	*			trans	-66.3	163.4	167.6	-66	-83.2	102.8	0	0	111.3
342	D	39.1	Very low	36.7	Very low	120 Å²	120	136.3 Å²	136.3	64%	0.642	72%	0.72	S	S	*	*			cis	-165.4	-174.2	47.2	-137.9	-47.3	0	0	0	115.6
343	K	38.8	Very low	36.5	Very low	158 Å²	158	134.6 Å²	134.6	69%	0.687	72%	0.718	S	S	*	*			trans	-88.1	153.2	-167.9	-35.3	118	-168.9	121.6	0	114.3
344	N	34.1	Very low	36	Very low	158 Å²	158	135.2 Å²	135.2	85%	0.845	72%	0.721	S	S	*	*				-171.8	159.5	104.4	-115.3	-14	0	0	0	116.8
345	S	36.1	Very low	36.1	Very low	80 Å²	80	134.5 Å²	134.5	56%	0.559	72%	0.721	S	S	*	*			trans	-79.6	152.8	-178.3	52.5	0	0	0	0	115.8
346	N	36.9	Very low	36	Very low	131 Å²	131	136.7 Å²	136.7	70%	0.701	73%	0.728	S	S	*	*				169.9	137.9	105.2	-90.3	-43.4	0	0	0	117.3
347	N	36.8	Very low	35.5	Very low	115 Å²	115	138 Å²	138	62%	0.615	74%	0.737	S	S	*	*			trans	78.2	137.1	134.2	-76.7	-16.6	0	0	0	126.4
348	F	36.2	Very low	35.2	Very low	172 Å²	172	139.7 Å²	139.7	75%	0.754	74%	0.74	S	S	*	*			trans	62.1	132	146	-63.8	-47	0	0	0	119.7
349	N	34.9	Very low	34.6	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	75%	0.748	S	S	*	*			cis	-145.9	154	20.1	-91.4	-47.6	0	0	0	113.9
350	T	30.1	Very low	34.4	Very low	129 Å²	129	142.8 Å²	142.8	79%	0.791	75%	0.751	S	S	*	*			trans	-113	140.1	164.9	-62.6	0	0	0	0	109.2
351	V	34.8	Very low	33.9	Very low	126 Å²	126	143.6 Å²	143.6	76%	0.764	75%	0.753	S	S	*	*			trans	-116.4	116.7	170.1	178.5	0	0	0	0	109.4	I353	V351-I353 HydrophobicContact CG1-CG1 4.43Å
352	L	30.5	Very low	33.6	Very low	151 Å²	151	144 Å²	144	79%	0.791	76%	0.755	S	S	*	*			trans	-92	140.8	166.4	-79.1	162.1	0	0	0	109.2
353	I	34.1	Very low	33.4	Very low	154 Å²	154	145 Å²	145	79%	0.79	76%	0.76	S	S	*	*			trans	-132.6	116.1	155.8	-58.6	-179.5	0	0	0	106.1	V351	V351-I353 HydrophobicContact CG1-CG1 4.43Å
354	D	26.4	Very low	32.9	Very low	134 Å²	134	144.3 Å²	144.3	72%	0.717	76%	0.764	S	S	*	*			trans	-123.4	129.8	177	-156.1	-11.5	0	0	0	106.2
355	S	35.3	Very low	33.1	Very low	98 Å²	98	146.2 Å²	146.2	69%	0.685	77%	0.765	S	S	*	*			trans	-155	74.6	-169.6	-71.4	0	0	0	0	113.1
356	Q	33.9	Very low	32.9	Very low	199 Å²	199	149.8 Å²	149.8	93%	0.93	78%	0.778	S	S	*	*			trans	56.2	139.1	136.2	-61.5	-177	-0.3	0	0	120.5
357	S	28.5	Very low	32.7	Very low	112 Å²	112	148.3 Å²	148.3	78%	0.783	78%	0.778	S	S	*	*			trans	-97.7	144.4	-179.8	53.9	0	0	0	0	112.8
358	E	31.6	Very low	32.6	Very low	170 Å²	170	149.5 Å²	149.5	79%	0.794	78%	0.784	S	S	*	*			trans	-129.1	127	149.7	-76.4	-162.8	111.5	0	0	110.2
359	N	28.9	Very low	32.6	Very low	166 Å²	166	148.4 Å²	148.4	89%	0.888	79%	0.786	S	S	*	*			trans	-124.3	129.8	161.7	-96.4	-25.6	0	0	0	106
360	Q	35.4	Very low	32.4	Very low	173 Å²	173	146.9 Å²	146.9	81%	0.808	79%	0.786	S	S	*	*			trans	-122.8	165.8	171.2	-69.4	-162.9	22.7	0	0	111.2
361	F	28.2	Very low	32.5	Very low	190 Å²	190	147.2 Å²	147.2	83%	0.833	79%	0.788	S	S	*	*			trans	-107.2	-169.7	-153.4	-140.9	-103.7	0	0	0	112.2
362	M	35.1	Very low	32.3	Very low	149 Å²	149	150 Å²	150	73%	0.734	79%	0.792	S	S	*	*			trans	78.2	142.7	172.8	-45.3	-52.7	-168.3	0	0	115.1
363	D	34.8	Very low	32.4	Very low	139 Å²	139	149.9 Å²	149.9	74%	0.743	80%	0.798	S	S	*	*			cis	-150.8	161	-5.2	-131.8	-29.4	0	0	0	111.8
364	N	28.4	Very low	32.2	Very low	145 Å²	145	147.7 Å²	147.7	78%	0.775	80%	0.797	S	S	*	*			trans	-126.6	124.1	-172	-134.5	0.5	0	0	0	111.3
365	K	37.8	Very low	32.7	Very low	198 Å²	198	148.1 Å²	148.1	86%	0.861	81%	0.805	S	S	*	*			trans	-144.1	126.4	169.6	-71.9	-166.1	177.4	-179.8	0	113.3
366	N	31.5	Very low	32.6	Very low	154 Å²	154	150.1 Å²	150.1	82%	0.824	81%	0.808	S	S	*	*			trans	-84.7	158.9	165.5	-63.4	-25.6	0	0	0	110.6
367	S	34.5	Very low	32.6	Very low	100 Å²	100	146.1 Å²	146.1	70%	0.699	79%	0.793	S	S	*	*				172.1	116.6	117.8	60.1	0	0	0	0	114.5
368	D	34.8	Very low	33	Very low	141 Å²	141	150.5 Å²	150.5	75%	0.754	79%	0.792	S	S	*	*				76.2	150.9	127.5	-51	-13.1	0	0	0	125.4
369	N	35.1	Very low	33	Very low	149 Å²	149	148.8 Å²	148.8	80%	0.797	79%	0.788	S	S	*	*			trans	82.3	88	151.8	-62.9	-33.8	0	0	0	122.7
370	S	30.3	Very low	33.2	Very low	107 Å²	107	148.6 Å²	148.6	75%	0.748	79%	0.786	S	S	*	*				33.9	127.6	105.3	-166.6	0	0	0	0	120.7
371	V	33.6	Very low	33.1	Very low	136 Å²	136	145.5 Å²	145.5	82%	0.824	78%	0.783	S	S	*	*				-178.9	152	113.8	147.7	0	0	0	0	110.3
372	Q	28.9	Very low	33.3	Very low	184 Å²	184	142.7 Å²	142.7	86%	0.86	79%	0.785	S	S	*	*			trans	-100.2	146.4	177.7	-59.4	159.2	-93.8	0	0	112.3
373	T	33.7	Very low	33.2	Very low	150 Å²	150	142.7 Å²	142.7	92%	0.92	79%	0.788	S	S	*	*			trans	-145	157.2	145.3	43	0	0	0	0	110.7
374	S	30.7	Very low	33.2	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	79%	0.788	S	S	*	*			trans	-134.2	149.2	-175.2	55	0	0	0	0	110.9
375	T	36.2	Very low	33.3	Very low	143 Å²	143	139.2 Å²	139.2	88%	0.877	79%	0.786	S	S	*	*			trans	-158.9	152.2	149.8	14.8	0	0	0	0	111.6
376	D	33	Very low	32.8	Very low	140 Å²	140	136.6 Å²	136.6	75%	0.749	79%	0.787	S	S	*	*			trans	-84.6	166	-173.5	-43.9	-97.6	0	0	0	113.7
377	N	34.5	Very low	32.8	Very low	115 Å²	115	134.4 Å²	134.4	62%	0.615	78%	0.783	S	S	*	*				179.3	136.8	104.8	-98.2	-83.5	0	0	0	112.8
378	R	36.6	Very low	32.6	Very low	203 Å²	203	137.6 Å²	137.6	77%	0.766	79%	0.791	S	S	*	*				33.8	150.6	127	-60.9	-175.1	178	114.2	-7	120.9
379	D	30.9	Very low	32.4	Very low	134 Å²	134	138.7 Å²	138.7	72%	0.717	80%	0.796	S	S	*	*			cis	-160.2	171.3	-17	-84.1	-34.1	0	0	0	103.7
380	I	33.7	Very low	32.2	Very low	163 Å²	163	136.7 Å²	136.7	84%	0.836	79%	0.794	S	S	*	*				-174.7	151	64.2	-76.6	178	0	0	0	106.9
381	S	32.5	Very low	32.4	Very low	107 Å²	107	138.4 Å²	138.4	75%	0.748	80%	0.795	S	S	*	*			trans	-93.7	159.6	176.8	60.3	0	0	0	0	114.8
382	C	34	Very low	32.5	Very low	132 Å²	132	140.1 Å²	140.1	89%	0.892	79%	0.794	S	S	*	*				-149.1	152.2	127.6	59.9	0	0	0	0	111.4
383	D	31.3	Very low	32.4	Very low	148 Å²	148	136.8 Å²	136.8	79%	0.791	79%	0.789	S	S	*	*			trans	-150.6	156.3	-167	-168.5	2.3	0	0	0	109.4
384	S	34.7	Very low	32.4	Very low	107 Å²	107	135.1 Å²	135.1	75%	0.748	78%	0.784	S	S	*	*			trans	160.9	143.2	154.7	-80.4	0	0	0	0	111.2
385	S	31.2	Very low	32.4	Very low	104 Å²	104	138.2 Å²	138.2	73%	0.727	79%	0.786	S	S	*	*			cis	147.9	152	-21.1	62.5	0	0	0	0	107.5
386	V	27.7	Very low	32.2	Very low	144 Å²	144	137.5 Å²	137.5	87%	0.873	78%	0.777	S	S	*	*			trans	-124.1	144.9	-172	179.1	0	0	0	0	109.8
387	S	31.2	Very low	32.2	Very low	107 Å²	107	137.6 Å²	137.6	75%	0.748	78%	0.778	S	S	*	*			trans	-124.3	145.4	177.3	54.3	0	0	0	0	113
388	L	29.7	Very low	32	Very low	167 Å²	167	138.2 Å²	138.2	87%	0.874	79%	0.786	S	S	*	*			trans	-130.3	143.3	172.9	-80.1	169.1	0	0	0	108.2
389	L	31.5	Very low	32.1	Very low	164 Å²	164	134 Å²	134	86%	0.859	79%	0.785	S	S	*	*			trans	-130	149.6	164.8	-86.3	92.1	0	0	0	110.5
390	S	30.6	Very low	32	Very low	107 Å²	107	134.4 Å²	134.4	75%	0.748	79%	0.787	S	S	*	*			trans	-101.3	166.4	174.4	-60.1	0	0	0	0	110.7
391	N	34.3	Very low	32	Very low	143 Å²	143	133.1 Å²	133.1	77%	0.765	79%	0.787	S	S	*	*				-176	134	127.1	-94.9	-16.9	0	0	0	116.4
392	H	35.7	Very low	32	Very low	173 Å²	173	133.9 Å²	133.9	80%	0.801	79%	0.787	S	S	*	*			trans	66	164.6	146.6	-74	-68.9	0	0	0	123.6
393	C	27.1	Very low	31.6	Very low	113 Å²	113	133.2 Å²	133.2	76%	0.764	78%	0.779	S	S	*	*			trans	-102.1	168.7	-162.1	-45.6	0	0	0	0	112
394	S	33.1	Very low	31.6	Very low	116 Å²	116	132.3 Å²	132.3	81%	0.811	78%	0.779	S	S	*	*				-166.5	165.2	74	-80.6	0	0	0	0	116.1
395	Q	31.9	Very low	31.3	Very low	172 Å²	172	132 Å²	132	80%	0.804	77%	0.773	S	S	*	*			trans	-32.7	143.3	175.1	-54.5	159.8	-23.2	0	0	117.8
396	N	31	Very low	31.2	Very low	129 Å²	129	135.6 Å²	135.6	69%	0.69	78%	0.78	S	S	*	*				-173.8	146.9	100.1	-100.3	7.7	0	0	0	115.6
397	D	32	Very low	31.2	Very low	142 Å²	142	138.5 Å²	138.5	76%	0.759	78%	0.777	S	S	*	*			trans	61	146.9	150.6	-54.8	-38.9	0	0	0	123.8
398	T	31.1	Very low	31.1	Very low	127 Å²	127	140 Å²	140	78%	0.779	78%	0.782	S	S	*	*			trans	-138.4	170	175.7	61.1	0	0	0	0	108.9
399	P	37.7	Very low	31	Very low	115 Å²	115	139 Å²	139	75%	0.747	78%	0.777	S	S	*	*				-151.3	144.6	100	36.6	-18.9	0	0	0	117.3
400	N	30.8	Very low	30.9	Very low	142 Å²	142	135.4 Å²	135.4	76%	0.759	77%	0.766	S	S	*	*			trans	16.5	129.6	140.3	-55.5	-28.6	0	0	0	120.9
401	T	31.8	Very low	30.8	Very low	136 Å²	136	138.5 Å²	138.5	83%	0.834	77%	0.768	S	S	*	*			trans	-143.2	99.7	134.5	-63.7	0	0	0	0	111.8
402	T	32.4	Very low	30.4	Very low	124 Å²	124	137.2 Å²	137.2	76%	0.761	77%	0.771	S	S	*	*			trans	28.8	117.9	140.6	-41.8	0	0	0	0	120.6
403	T	27.3	Very low	30.1	Very low	118 Å²	118	135 Å²	135	72%	0.724	77%	0.77	S	S	*	*			trans	-66.1	148.4	164.6	-47.6	0	0	0	0	112.8
404	T	31	Very low	30	Very low	129 Å²	129	137 Å²	137	79%	0.791	77%	0.773	S	S	*	*			trans	-139.5	118.4	152.1	-69.7	0	0	0	0	110.1
405	T	28.1	Very low	29.9	Very low	99 Å²	99	137.8 Å²	137.8	61%	0.607	77%	0.773	S	S	*	*			trans	-92	131.3	-177	-22.5	0	0	0	0	110.2	Y407	T405-Y407 HydrophobicContact CG2-CD2 4.2Å; T405-Y407 HydrophobicContact CG2-CE2 4.07Å
406	M	29.9	Very low	29.9	Very low	180 Å²	180	134.1 Å²	134.1	89%	0.887	76%	0.755	S	S	*	*			trans	-134.8	126.2	162	-74.6	-64.7	-86	0	0	110
407	Y	26.9	Very low	29.8	Very low	206 Å²	206	134.1 Å²	134.1	81%	0.808	76%	0.755	S	S	*	*			trans	-99.6	133	179.5	-89.6	-108.7	0	0	0	111.1	T405	T405-Y407 HydrophobicContact CG2-CD2 4.2Å; T405-Y407 HydrophobicContact CG2-CE2 4.07Å
408	T	29.4	Very low	29.8	Very low	138 Å²	138	132.5 Å²	132.5	85%	0.847	75%	0.75	S	S	*	*			trans	178.9	112.2	148.2	39.4	0	0	0	0	106
409	N	27.7	Very low	29.7	Very low	146 Å²	146	137 Å²	137	78%	0.781	76%	0.755	S	S	*	*			cis	81.6	127.1	33.9	-154.9	34.9	0	0	0	114.7
410	S	28.5	Very low	29.3	Very low	89 Å²	89	137 Å²	137	62%	0.622	75%	0.748	S	S	*	*			trans	59	145.2	-179.8	48	0	0	0	0	116.6
411	H	29.8	Very low	29.3	Very low	171 Å²	171	138.8 Å²	138.8	79%	0.792	75%	0.749	S	S	*	*			cis	-136.2	156	29.8	-78.8	-88.7	0	0	0	115.3
412	S	25.9	Very low	29.4	Very low	117 Å²	117	137.9 Å²	137.9	82%	0.818	74%	0.739	S	S	*	*			trans	-84.7	142.3	159.3	43.1	0	0	0	0	111.1
413	T	29	Very low	29.4	Very low	127 Å²	127	138.3 Å²	138.3	78%	0.779	73%	0.733	S	S	*	*			trans	-114.2	116.8	169.3	49.1	0	0	0	0	109.8	T415	T413-T415 PolarHBondContact O-N 2.97Å
414	N	25.3	Very low	29.4	Very low	155 Å²	155	137.7 Å²	137.7	83%	0.829	73%	0.732	S	S	*	*			trans	-79.7	115.1	173.2	-138.9	5.5	0	0	0	108.3
415	T	30.2	Very low	29.3	Very low	132 Å²	132	137.7 Å²	137.7	81%	0.81	73%	0.727	S	S	*	*			trans	-109.3	84.4	171.1	54.1	0	0	0	0	108.8	T413	T413-T415 PolarHBondContact O-N 2.97Å
416	H	32.4	Very low	29.7	Very low	95 Å²	95	140.1 Å²	140.1	44%	0.44	74%	0.736	S	S	.	*			trans	-71	172.7	171.4	-145.6	-104.3	0	0	0	110.2	V418 D482 S484	H416-V418 PolarHBondContact O-N 3.22Å; H416-D482 IonicContact CD2-OD2 2.68Å; H416-D482 IonicContact CE1-OD1 3.95Å; H416-D482 IonicContact NE2-OD1 3.62Å; H416-D482 PolarHBondContact NE2-OD1 3.45Å; H416-D482 IonicContact NE2-OD2 3.26Å; H416-D482 PolarHBondContact NE2-OD2 3.36Å; H416-S484 PolarHBondContact NE2-OG 3.38Å
417	D	29.2	Very low	29.7	Very low	128 Å²	128	137.9 Å²	137.9	68%	0.684	74%	0.736	S	S	*	*			trans	-57.4	124.4	-172	-69.7	-75.3	0	0	0	113.9
418	V	31.9	Very low	29.9	Very low	109 Å²	109	139 Å²	139	66%	0.661	74%	0.739	S	S	*	*			trans	-131.5	85.1	158.8	-166.2	0	0	0	0	109.7	H416 N420	H416-V418 PolarHBondContact O-N 3.22Å; V418-N420 HydrophobicContact CG1-CB 3.75Å; V418-N420 PolarHBondContact O-N 3.19Å
419	Y	27.7	Very low	30.2	Very low	222 Å²	222	140 Å²	140	87%	0.871	74%	0.739	S	S	*	*			trans	-73.8	58.2	173.2	-152.6	-90.1	0	0	0	110.5	K421	Y419-K421 PolarHBondContact O-N 3.34Å
420	N	30.7	Very low	30.5	Very low	113 Å²	113	136.4 Å²	136.4	60%	0.604	74%	0.736	S	S	*	*			trans	-76.3	99.8	-166	-118.4	3.9	0	0	0	112.4	V418 N422	V418-N420 HydrophobicContact CG1-CB 3.75Å; V418-N420 PolarHBondContact O-N 3.19Å; N420-N422 PolarHBondContact ND2-ND2 2.87Å; N420-N422 PolarHBondContact O-N 2.73Å
421	K	29.6	Very low	30.8	Very low	180 Å²	180	137.7 Å²	137.7	78%	0.783	75%	0.745	S	S	*	*			trans	-74.5	66.7	172.1	-170.4	-177.1	175.8	-178.3	0	110.7	Y419 Q423	Y419-K421 PolarHBondContact O-N 3.34Å; K421-Q423 WeakPolarHBondContact O-CB 3.45Å
422	N	33.7	Very low	31.2	Very low	117 Å²	117	134.8 Å²	134.8	63%	0.626	75%	0.745	S	S	*	*			trans	-101.1	96.3	173.9	-55.8	3.2	0	0	0	106	N420	N420-N422 PolarHBondContact ND2-ND2 2.87Å; N420-N422 PolarHBondContact O-N 2.73Å
423	Q	32.4	Very low	31.7	Very low	133 Å²	133	137.3 Å²	137.3	62%	0.621	74%	0.743	S	S	*	*			cis	49	79.4	49.7	-167.9	153.2	-5	0	0	111.5	K421 D425	K421-Q423 WeakPolarHBondContact O-CB 3.45Å; Q423-D425 WeakPolarHBondContact CG-OD1 3.5Å; Q423-D425 WeakPolarHBondContact CG-OD2 3.31Å; Q423-D425 PolarHBondContact NE2-OD1 3.25Å; Q423-D425 PolarHBondContact NE2-OD2 3.11Å; Q423-D425 VanDerWaalsContact NE2-OD2 3.09Å
424	C	28.8	Very low	32.1	Very low	105 Å²	105	136.6 Å²	136.6	71%	0.709	74%	0.738	S	S	*	*			trans	-93.5	93.2	167.7	-173.7	0	0	0	0	108.3	L426	C424-L426 VanDerWaalsContact C-N 3.27Å; C424-L426 PolarHBondContact O-N 2.74Å
425	D	28.6	Very low	32.7	Very low	130 Å²	130	136.7 Å²	136.7	70%	0.695	74%	0.739	S	S	*	*			trans	-76.6	73.3	-179	-72.4	-44.3	0	0	0	111.6	Q423	Q423-D425 WeakPolarHBondContact CG-OD1 3.5Å; Q423-D425 WeakPolarHBondContact CG-OD2 3.31Å; Q423-D425 PolarHBondContact NE2-OD1 3.25Å; Q423-D425 PolarHBondContact NE2-OD2 3.11Å; Q423-D425 VanDerWaalsContact NE2-OD2 3.09Å
426	L	35.2	Very low	32.8	Very low	149 Å²	149	137.6 Å²	137.6	78%	0.78	74%	0.739	S	S	*	*			trans	-133.4	12.5	178.1	-95.5	174.3	0	0	0	115.3	C424	C424-L426 VanDerWaalsContact C-N 3.27Å; C424-L426 PolarHBondContact O-N 2.74Å
427	C	30	Very low	33	Very low	133 Å²	133	137.5 Å²	137.5	90%	0.899	75%	0.747	S	S	*	*	S	Bend	trans	-129.6	47.7	-173.9	-66.8	0	0	0	0	114.4
428	R	32.4	Very low	33.3	Very low	231 Å²	231	138.5 Å²	138.5	87%	0.872	75%	0.75	S	S	*	*			trans	-154.4	100.3	177	-170.4	175.8	-176.3	171.9	1.4	114.7
429	N	35.7	Very low	33.5	Very low	158 Å²	158	137.9 Å²	137.9	85%	0.845	75%	0.751	S	S	*	*			trans	170.1	140.5	141.2	-87.9	-18.6	0	0	0	111.5
430	G	34.1	Very low	33.8	Very low	70 Å²	70	134 Å²	134	72%	0.722	75%	0.746	S	S	*	*			trans	68.3	112.8	170.7	0	0	0	0	0	115.1
431	S	35	Very low	33.9	Very low	116 Å²	116	135.4 Å²	135.4	81%	0.811	75%	0.753	S	S	*	*			cis	72.5	114.8	29.2	-44.1	0	0	0	0	115
432	S	37.5	Very low	34.2	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	76%	0.759	S	S	*	*			trans	70.2	143.3	171.9	-59.8	0	0	0	0	116.9
433	Q	36.5	Very low	34.1	Very low	169 Å²	169	138.4 Å²	138.4	79%	0.79	77%	0.771	S	S	*	*			cis	-159.8	142.7	-12	-116	-174.9	0.3	0	0	110.6
434	V	36.5	Very low	34.1	Very low	112 Å²	112	137.5 Å²	137.5	68%	0.679	78%	0.78	S	S	*	*			trans	75.3	151.9	138.9	170.9	0	0	0	0	120.4
435	D	37.8	Very low	34.3	Very low	157 Å²	157	137.9 Å²	137.9	84%	0.84	78%	0.779	S	S	*	*			trans	75.8	153.2	171.9	-65.4	-26.2	0	0	0	122.2
436	N	32.2	Very low	34.4	Very low	151 Å²	151	136.9 Å²	136.9	81%	0.807	78%	0.781	S	S	*	*			trans	-168.6	175.2	-151.2	-141.8	-1.9	0	0	0	106.5
437	P	38.2	Very low	34.2	Very low	94 Å²	94	136.8 Å²	136.8	61%	0.61	78%	0.776	S	S	*	*			cis	-129.6	-159.8	-20.4	24.1	1.7	0	0	0	112.1
438	I	35.5	Very low	34.3	Very low	148 Å²	148	139.1 Å²	139.1	76%	0.759	77%	0.773	S	S	*	*			trans	119.5	120.6	144.7	-63	165.8	0	0	0	118.6
439	S	35.3	Very low	34.3	Very low	97 Å²	97	135.4 Å²	135.4	68%	0.678	77%	0.766	S	S	*	*			trans	88.5	118.9	151.3	71.7	0	0	0	0	122.9
440	N	34.1	Very low	34.3	Very low	141 Å²	141	132 Å²	132	75%	0.754	76%	0.759	S	S	*	*			trans	73.4	105	132.4	-63	-6	0	0	0	123.1
441	N	32.2	Very low	34.4	Very low	142 Å²	142	133.5 Å²	133.5	76%	0.759	75%	0.754	S	S	*	*				46.7	112.4	127	-66.5	-7.7	0	0	0	120.7
442	Q	37	Very low	34.3	Very low	196 Å²	196	133.3 Å²	133.3	92%	0.916	74%	0.739	S	S	*	*				-156	156	116.9	-112	147.5	101.5	0	0	112.8
443	N	31	Very low	34.1	Very low	163 Å²	163	135.6 Å²	135.6	87%	0.872	74%	0.738	S	S	*	*			trans	-81.5	139	-179.5	-67.2	-38.8	0	0	0	111.3
444	S	33.6	Very low	34.1	Very low	115 Å²	115	133.8 Å²	133.8	80%	0.804	74%	0.738	S	S	*	*			trans	-137.6	82.5	168.6	62.5	0	0	0	0	111.3	C446	S444-C446 PolarHBondContact O-N 3.16Å
445	T	32.8	Very low	33.9	Very low	113 Å²	113	135.8 Å²	135.8	69%	0.693	75%	0.745	S	S	*	*			trans	-75.2	106.4	177.7	-50.5	0	0	0	0	110.6	H447	T445-H447 PolarHBondContact O-N 3.04Å
446	C	29	Very low	33.6	Very low	109 Å²	109	135.6 Å²	135.6	74%	0.736	74%	0.744	S	S	*	*			trans	-75.9	90.8	178.7	53.1	0	0	0	0	112.2	S444 H448	S444-C446 PolarHBondContact O-N 3.16Å; C446-H448 PolarHBondContact O-N 2.98Å
447	H	32	Very low	33.7	Very low	146 Å²	146	133.7 Å²	133.7	68%	0.676	74%	0.74	S	S	*	*			trans	-73.5	109.1	170	-81.7	-102.7	0	0	0	111.3	T445	T445-H447 PolarHBondContact O-N 3.04Å
448	H	32.9	Very low	33.6	Very low	182 Å²	182	136 Å²	136	84%	0.843	75%	0.747	S	S	*	*			trans	-101.8	98.3	161.6	-84.7	-78.1	0	0	0	110.4	C446 A450	C446-H448 PolarHBondContact O-N 2.98Å; H448-A450 PolarHBondContact O-N 3.26Å
449	H	32.6	Very low	33.6	Very low	154 Å²	154	136.4 Å²	136.4	71%	0.713	75%	0.751	S	S	*	*			trans	-71.5	119.6	166.1	-89.8	-125.2	0	0	0	109.9	V451	H449-V451 HydrophobicContact CB-CG2 4.21Å
450	A	34.5	Very low	33.6	Very low	85 Å²	85	141.3 Å²	141.3	70%	0.702	75%	0.754	S	S	*	*			trans	-89.8	96.1	160.8	0	0	0	0	0	108.3	H448	H448-A450 PolarHBondContact O-N 3.26Å
451	V	35.4	Very low	33.7	Very low	102 Å²	102	141.4 Å²	141.4	62%	0.618	76%	0.755	S	S	*	*			trans	-80.4	126.6	178.5	-176.6	0	0	0	0	109.6	H449 E453	H449-V451 HydrophobicContact CB-CG2 4.21Å; V451-E453 HydrophobicContact CB-CG 4.46Å; V451-E453 HydrophobicContact CG1-CG 3.79Å; V451-E453 PolarHBondContact O-N 3.18Å
452	F	34.4	Very low	33.9	Very low	112 Å²	112	140.7 Å²	140.7	49%	0.491	76%	0.761	S	S	.	*			trans	-78.4	94.8	164	-83.4	-96.1	0	0	0	108.6	Y82 T454	Y82-F452 HydrophobicContact CE1-CE1 4.16Å; F452-T454 PolarHBondContact O-N 3.39Å
453	E	32.4	Very low	33.8	Very low	160 Å²	160	136.2 Å²	136.2	75%	0.748	76%	0.757	S	S	*	*			trans	-82.9	113.2	172.3	-68.7	-165.2	135.4	0	0	111.1	V451 N455	V451-E453 HydrophobicContact CB-CG 4.46Å; V451-E453 HydrophobicContact CG1-CG 3.79Å; V451-E453 PolarHBondContact O-N 3.18Å; E453-N455 PolarHBondContact O-N 3.49Å
454	T	36.2	Very low	34.1	Very low	130 Å²	130	137.8 Å²	137.8	80%	0.798	76%	0.756	S	S	*	*			trans	-79.7	106	166.9	51	0	0	0	0	109	F452 N456	F452-T454 PolarHBondContact O-N 3.39Å; T454-N456 PolarHBondContact O-N 3.14Å
455	N	32.5	Very low	34.1	Very low	155 Å²	155	143.9 Å²	143.9	83%	0.829	76%	0.762	S	S	*	*			trans	-60	120.9	-176.4	-77.9	-57.1	0	0	0	112.8	E453	E453-N455 PolarHBondContact O-N 3.49Å
456	N	32.7	Very low	34.2	Very low	153 Å²	153	143.2 Å²	143.2	82%	0.818	76%	0.762	S	S	*	*			trans	-106.4	117	166	-175.6	25.4	0	0	0	108.7	T454 D458	T454-N456 PolarHBondContact O-N 3.14Å; N456-D458 PolarHBondContact O-N 3.48Å
457	P	33.6	Very low	34.6	Very low	110 Å²	110	150.4 Å²	150.4	71%	0.714	77%	0.773	S	S	*	*			trans	-93.9	99.5	-166.1	34.3	-33.6	0	0	0	113.6
458	D	36.8	Very low	34.6	Very low	144 Å²	144	147.8 Å²	147.8	77%	0.77	78%	0.777	S	S	*	*			trans	-165	87	159.5	-122.2	-23.9	0	0	0	114.5	N456	N456-D458 PolarHBondContact O-N 3.48Å
459	N	35.2	Very low	34.9	Very low	156 Å²	156	146.6 Å²	146.6	83%	0.834	78%	0.776	S	S	*	*			trans	-162	151.3	131.4	-129.9	-34.2	0	0	0	117
460	R	35.6	Very low	34.9	Very low	199 Å²	199	146.4 Å²	146.4	75%	0.751	78%	0.78	S	S	*	*			trans	-80.9	143.1	-164.2	-70	153.4	-175.3	-167.5	1.7	115.5
461	N	34.3	Very low	34.8	Very low	144 Å²	144	146.8 Å²	146.8	77%	0.77	78%	0.778	S	S	*	*			trans	62.8	98.2	132.1	-57.8	-14.1	0	0	0	121.7
462	S	36.6	Very low	35	Very low	126 Å²	126	147.2 Å²	147.2	88%	0.881	79%	0.786	S	S	*	*				169.6	148.6	127.6	-79.9	0	0	0	0	110.6
463	A	35.9	Very low	34.9	Very low	102 Å²	102	150.2 Å²	150.2	84%	0.843	81%	0.806	S	S	*	*			cis	-139	178.7	3.9	0	0	0	0	0	112.2
464	K	36.6	Very low	35	Very low	196 Å²	196	148.6 Å²	148.6	85%	0.852	80%	0.801	S	S	*	*			trans	-97.9	147.1	-168.1	-56.3	166	-178.1	172.3	0	113.9
465	R	34.7	Very low	34.7	Very low	244 Å²	244	148.1 Å²	148.1	92%	0.921	80%	0.803	S	S	*	*			trans	179.1	85.7	141.9	-100.7	162.8	-176.9	-163.9	1.6	110.8
466	S	35	Very low	35.1	Very low	99 Å²	99	146.1 Å²	146.1	69%	0.692	79%	0.792	S	S	*	*				78.3	98.1	67.6	76.7	0	0	0	0	116.3
467	R	35.9	Very low	35.2	Very low	259 Å²	259	146.6 Å²	146.6	98%	0.977	79%	0.789	S	S	*	*			trans	-177.8	136.8	142.1	-99.8	157.4	-169.7	166.6	2.9	109.2
468	A	32.4	Very low	35.3	Very low	92 Å²	92	148 Å²	148	76%	0.76	79%	0.791	S	S	*	*			trans	-155.1	143.5	178.3	0	0	0	0	0	110.1
469	L	39	Very low	35.2	Very low	156 Å²	156	148.3 Å²	148.3	82%	0.817	79%	0.792	S	S	*	*			trans	-152.4	119.7	170.7	-77.4	-177.1	0	0	0	112.9
470	N	33.2	Very low	35.5	Very low	150 Å²	150	146.4 Å²	146.4	80%	0.802	78%	0.782	S	S	*	*			trans	70.3	156.1	133.8	-61.9	-3.1	0	0	0	123.9
471	S	33.2	Very low	35.9	Very low	94 Å²	94	143.8 Å²	143.8	66%	0.657	78%	0.783	S	S	*	*			trans	68.6	117.2	176.3	-126.5	0	0	0	0	116.3
472	S	37.8	Very low	36.8	Very low	110 Å²	110	140 Å²	140	77%	0.769	76%	0.763	S	S	*	*			cis	76.2	130.2	24.5	-41.6	0	0	0	0	115.2
473	L	33.3	Very low	37.7	Very low	175 Å²	175	138.5 Å²	138.5	92%	0.916	75%	0.75	S	S	*	*			trans	-32.3	122.1	-179.2	-73.3	159.4	0	0	0	116.2
474	I	34.4	Very low	39.1	Very low	126 Å²	126	135.1 Å²	135.1	65%	0.646	72%	0.72	S	S	*	*			trans	-141.6	135	143.5	-36.9	176	0	0	0	107.8	L476	I474-L476 HydrophobicContact CB-CD1 4.24Å; I474-L476 HydrophobicContact CB-CG 4.18Å; I474-L476 HydrophobicContact CD1-CD1 4.27Å; I474-L476 HydrophobicContact CG2-CD1 4.02Å; I474-L476 HydrophobicContact CG2-CD2 4.06Å; I474-L476 HydrophobicContact CG2-CG 3.69Å
475	S	29.5	Very low	40.5	Very low	120 Å²	120	130.4 Å²	130.4	84%	0.839	70%	0.699	S	S	*	*			trans	-83.1	110.1	163.3	-60.4	0	0	0	0	108.4
476	L	40.8	Very low	42	Very low	113 Å²	113	121.6 Å²	121.6	59%	0.592	67%	0.673	S	S	*	*			trans	-133.8	113.9	172.7	-64.6	173.1	0	0	0	106.1	I474	I474-L476 HydrophobicContact CB-CD1 4.24Å; I474-L476 HydrophobicContact CB-CG 4.18Å; I474-L476 HydrophobicContact CD1-CD1 4.27Å; I474-L476 HydrophobicContact CG2-CD1 4.02Å; I474-L476 HydrophobicContact CG2-CD2 4.06Å; I474-L476 HydrophobicContact CG2-CG 3.69Å
477	E	35.8	Very low	43.8	Very low	164 Å²	164	120.8 Å²	120.8	77%	0.766	66%	0.664	S	S	*	*				74.7	132.8	79.6	-72.2	-175.2	159.9	0	0	112.9	N479	E477-N479 PolarHBondContact O-N 2.93Å; E477-N479 VanDerWaalsContact O-N 3.13Å; E477-N479 PolarHBondContact O-ND2 3.34Å
478	D	35	Very low	46.1	Very low	140 Å²	140	110.7 Å²	110.7	75%	0.749	63%	0.631	S	S	*	*			trans	-61.8	104.4	-164.8	-80.7	-78.7	0	0	0	115.2	N480	D478-N480 VanDerWaalsContact C-N 3.32Å; D478-N480 WeakPolarHBondContact CB-ND2 3.45Å; D478-N480 PolarHBondContact O-N 3.46Å; D478-N480 PolarHBondContact OD1-ND2 3.45Å
479	N	34.5	Very low	48.8	Very low	149 Å²	149	107.1 Å²	107.1	80%	0.797	60%	0.599	S	S	*	*			trans	-91.7	64.7	165.5	-78.3	-90.2	0	0	0	110.7	E477 N481	E477-N479 PolarHBondContact O-N 2.93Å; E477-N479 VanDerWaalsContact O-N 3.13Å; E477-N479 PolarHBondContact O-ND2 3.34Å; N479-N481 PolarHBondContact O-N 3.1Å
480	N	42.7	Very low	51.3	Low	116 Å²	116	104.5 Å²	104.5	62%	0.62	58%	0.582	S	S	*	*			trans	-72.3	38.2	-179.9	-82.3	-48.1	0	0	0	114.2	D478	D478-N480 VanDerWaalsContact C-N 3.32Å; D478-N480 WeakPolarHBondContact CB-ND2 3.45Å; D478-N480 PolarHBondContact O-N 3.46Å; D478-N480 PolarHBondContact OD1-ND2 3.45Å
481	N	44	Very low	54.2	Low	144 Å²	144	99.1 Å²	99.1	77%	0.77	55%	0.552	S	S	*	*			trans	-142.9	54.1	-173.4	-77.5	-58.8	0	0	0	113.3	N479 P483	N479-N481 PolarHBondContact O-N 3.1Å; N481-P483 WeakPolarHBondContact O-CD 3.42Å
482	D	53.3	Low	57.1	Low	66 Å²	66	94.8 Å²	94.8	35%	0.353	52%	0.521	S	S	.	.			trans	-86.9	115.5	156.6	-170.6	-18.3	0	0	0	108.8	H416 S484 K485 V486	H416-D482 IonicContact CD2-OD2 2.68Å; H416-D482 IonicContact CE1-OD1 3.95Å; H416-D482 IonicContact NE2-OD1 3.62Å; H416-D482 PolarHBondContact NE2-OD1 3.45Å; H416-D482 IonicContact NE2-OD2 3.26Å; H416-D482 PolarHBondContact NE2-OD2 3.36Å; D482-S484 VanDerWaalsContact C-N 3.27Å; D482-S484 PolarHBondContact O-N 3.43Å; D482-S484 PolarHBondContact OD1-N 2.98Å; D482-S484 PolarHBondContact OD1-OG 3.44Å; D482-S484 VanDerWaalsContact OD1-OG 3.05Å; D482-K485 HydrophobicContact CB-CB 4.3Å; D482-K485 PolarHBondContact O-N 2.88Å; D482-V486 PolarHBondContact O-N 3.49Å
483	P	55.6	Low	59.8	Low	94 Å²	94	92 Å²	92	61%	0.61	50%	0.496	S	S	*	.	H	α-helix	trans	-58	-33.6	-176.9	-26.3	35.8	0	0	0	114.3	N481 K485 V486 V487	N481-P483 WeakPolarHBondContact O-CD 3.42Å; P483-K485 VanDerWaalsContact C-N 3.32Å; P483-K485 PolarHBondContact O-N 3.14Å; P483-V486 PolarHBondContact O-N 3.34Å; P483-V487 WeakPolarHBondContact O-CB 3.3Å; P483-V487 VanDerWaalsContact O-CG2 3.27Å; P483-V487 WeakPolarHBondContact O-CG2 3.16Å; P483-V487 PolarHBondContact O-N 3.13Å
484	S	64.7	Low	62.7	Low	31 Å²	31	89.1 Å²	89.1	22%	0.217	48%	0.478	C	S	.	.	H	α-helix	trans	-65.5	-37.4	-178.9	63.4	0	0	0	0	111.9	H416 D482 T488	H416-S484 PolarHBondContact NE2-OG 3.38Å; D482-S484 VanDerWaalsContact C-N 3.27Å; D482-S484 PolarHBondContact O-N 3.43Å; D482-S484 PolarHBondContact OD1-N 2.98Å; D482-S484 PolarHBondContact OD1-OG 3.44Å; D482-S484 VanDerWaalsContact OD1-OG 3.05Å; S484-T488 VanDerWaalsContact O-CB 3.24Å; S484-T488 WeakPolarHBondContact O-CB 3.45Å; S484-T488 PolarHBondContact O-N 3.3Å; S484-T488 PolarHBondContact O-OG1 3.14Å
485	K	66.2	Low	65.6	Low	96 Å²	96	85.5 Å²	85.5	42%	0.417	46%	0.458	S	S	.	.	H	α-helix	trans	-70	-46.2	179.1	-167.4	162.3	-176.2	-75.8	0	111.3	D482 P483 V487 T488 D489 E516	D482-K485 HydrophobicContact CB-CB 4.3Å; D482-K485 PolarHBondContact O-N 2.88Å; P483-K485 VanDerWaalsContact C-N 3.32Å; P483-K485 PolarHBondContact O-N 3.14Å; K485-V487 PolarHBondContact O-N 3.09Å; K485-T488 WeakPolarHBondContact O-CB 3.33Å; K485-T488 PolarHBondContact O-N 3.42Å; K485-D489 PolarHBondContact O-N 2.9Å; K485-E516 WeakPolarHBondContact CE-OE1 3.47Å; K485-E516 WeakPolarHBondContact CG-OE1 3.23Å; K485-E516 IonicContact NZ-OE1 3.32Å; K485-E516 PolarHBondContact NZ-OE1 2.96Å; K485-E516 IonicContact NZ-OE2 2.95Å; K485-E516 PolarHBondContact NZ-OE2 2.85Å
486	V	65.6	Low	68.8	Low	60 Å²	60	79.8 Å²	79.8	36%	0.364	42%	0.418	S	S	.	.	H	α-helix	trans	-61.4	-45.3	175.5	178.1	0	0	0	0	111.6	D482 P483 T488 D489 Q490	D482-V486 PolarHBondContact O-N 3.49Å; P483-V486 PolarHBondContact O-N 3.34Å; V486-T488 VanDerWaalsContact C-N 3.29Å; V486-T488 PolarHBondContact O-N 2.94Å; V486-D489 PolarHBondContact O-N 3.3Å; V486-Q490 WeakPolarHBondContact O-CG 3.43Å; V486-Q490 PolarHBondContact O-N 2.97Å; V486-Q490 VanDerWaalsContact O-N 3.08Å
487	V	72.1	Confident	71.3	Confident	82 Å²	82	78.1 Å²	78.1	50%	0.497	41%	0.41	S	S	.	.	H	α-helix	trans	-62.8	-36.2	175.5	167.9	0	0	0	0	111.7	P483 K485 F491	P483-V487 WeakPolarHBondContact O-CB 3.3Å; P483-V487 VanDerWaalsContact O-CG2 3.27Å; P483-V487 WeakPolarHBondContact O-CG2 3.16Å; P483-V487 PolarHBondContact O-N 3.13Å; K485-V487 PolarHBondContact O-N 3.09Å; V487-F491 PolarHBondContact O-N 3.01Å; V487-F491 VanDerWaalsContact O-N 3.1Å
488	T	85	Confident	74.1	Confident	47 Å²	47	76.5 Å²	76.5	29%	0.288	40%	0.401	S	S	.	.	H	α-helix	trans	-66.6	-46.7	178.7	-71.3	0	0	0	0	112.6	S484 K485 V486 F491 V492 R530	S484-T488 VanDerWaalsContact O-CB 3.24Å; S484-T488 WeakPolarHBondContact O-CB 3.45Å; S484-T488 PolarHBondContact O-N 3.3Å; S484-T488 PolarHBondContact O-OG1 3.14Å; K485-T488 WeakPolarHBondContact O-CB 3.33Å; K485-T488 PolarHBondContact O-N 3.42Å; V486-T488 VanDerWaalsContact C-N 3.29Å; V486-T488 PolarHBondContact O-N 2.94Å; T488-F491 PolarHBondContact O-N 3.19Å; T488-V492 WeakPolarHBondContact O-CG2 3.41Å; T488-V492 PolarHBondContact O-N 2.92Å; T488-V492 VanDerWaalsContact O-N 3.14Å; T488-R530 HydrophobicContact CG2-CB 3.75Å
489	D	88.8	Confident	76.9	Confident	17 Å²	17	71.9 Å²	71.9	9%	0.091	37%	0.374	C	S	.	.	H	α-helix	trans	-66	-41.1	176.6	173.6	72.2	0	0	0	112.8	K485 V486 F491 V492 Q493 R513 E516 G517	K485-D489 PolarHBondContact O-N 2.9Å; V486-D489 PolarHBondContact O-N 3.3Å; D489-F491 VanDerWaalsContact C-N 3.29Å; D489-F491 PolarHBondContact O-N 2.99Å; D489-V492 PolarHBondContact O-N 3.49Å; D489-V492 VanDerWaalsContact O-N 3.11Å; D489-Q493 PolarHBondContact O-N 3.3Å; D489-R513 VanDerWaalsContact CG-NH1 3.33Å; D489-R513 VanDerWaalsContact CG-NH2 3.27Å; D489-R513 IonicContact OD1-CZ 2.92Å; D489-R513 IonicContact OD1-NH1 2.7Å; D489-R513 PolarHBondContact OD1-NH1 3.3Å; D489-R513 IonicContact OD1-NH2 3.89Å; D489-R513 PolarHBondContact OD1-NH2 3.12Å; D489-R513 IonicContact OD2-CZ 3.37Å; D489-R513 IonicContact OD2-NH1 2.59Å; D489-R513 PolarHBondContact OD2-NH1 3.26Å; D489-R513 IonicContact OD2-NH2 3.34Å; D489-R513 PolarHBondContact OD2-NH2 3.21Å; D489-E516 HydrophobicContact CB-CG 3.92Å; D489-E516 WeakPolarHBondContact OD1-CA 3.33Å; D489-G517 PolarHBondContact OD1-N 3.34Å
490	Q	91.9	Very high	79.6	Confident	100 Å²	100	65.9 Å²	65.9	47%	0.467	34%	0.342	S	S	.	.	H	α-helix	trans	-58.3	-42.3	175	-74.1	-177.4	23.5	0	0	111.6	V486 Q493 Q494	V486-Q490 WeakPolarHBondContact O-CG 3.43Å; V486-Q490 PolarHBondContact O-N 2.97Å; V486-Q490 VanDerWaalsContact O-N 3.08Å; Q490-Q493 PolarHBondContact O-N 2.93Å; Q490-Q494 WeakPolarHBondContact O-CB 3.39Å; Q490-Q494 WeakPolarHBondContact O-CG 3.17Å; Q490-Q494 PolarHBondContact O-N 3.44Å
491	F	93.6	Very high	82	Confident	37 Å²	37	63.5 Å²	63.5	16%	0.162	34%	0.338	C	S	.	.	H	α-helix	trans	-60.2	-45.4	173.7	176.8	-89.8	0	0	0	112	V487 T488 D489 Q494 Q495 R530 V535	V487-F491 PolarHBondContact O-N 3.01Å; V487-F491 VanDerWaalsContact O-N 3.1Å; T488-F491 PolarHBondContact O-N 3.19Å; D489-F491 VanDerWaalsContact C-N 3.29Å; D489-F491 PolarHBondContact O-N 2.99Å; F491-Q494 PolarHBondContact O-N 3.39Å; F491-Q495 HydrophobicContact CD1-CG 4.19Å; F491-Q495 HydrophobicContact CD2-CG 4.45Å; F491-Q495 HydrophobicContact CE1-CG 3.83Å; F491-Q495 HydrophobicContact CE2-CG 4.11Å; F491-Q495 HydrophobicContact CZ-CG 3.78Å; F491-Q495 WeakPolarHBondContact O-CG 3.24Å; F491-Q495 PolarHBondContact O-N 3.06Å; F491-R530 HydrophobicContact CD1-CB 4.27Å; F491-R530 HydrophobicContact CD1-CG 3.73Å; F491-R530 HydrophobicContact CE1-CG 3.86Å; F491-V535 HydrophobicContact CD1-CG2 4.2Å; F491-V535 HydrophobicContact CE1-CG2 3.87Å
492	V	95.3	Very high	84.2	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.018	32%	0.323	C	S	.	.	H	α-helix	trans	-59.4	-50.5	177.7	173.3	0	0	0	0	110.7	T488 D489 Q494 Q495 V496 Y519 L528 R530 V535	T488-V492 WeakPolarHBondContact O-CG2 3.41Å; T488-V492 PolarHBondContact O-N 2.92Å; T488-V492 VanDerWaalsContact O-N 3.14Å; D489-V492 PolarHBondContact O-N 3.49Å; D489-V492 VanDerWaalsContact O-N 3.11Å; V492-Q494 PolarHBondContact O-N 3.23Å; V492-Q495 PolarHBondContact O-N 3.02Å; V492-V496 HydrophobicContact CG1-CG2 4.36Å; V492-V496 WeakPolarHBondContact O-CB 3.43Å; V492-V496 VanDerWaalsContact O-CG2 3.27Å; V492-V496 WeakPolarHBondContact O-CG2 3.49Å; V492-V496 PolarHBondContact O-N 3.41Å; V492-Y519 HydrophobicContact CG1-CE2 4.01Å; V492-L528 HydrophobicContact CG1-CB 3.79Å; V492-L528 HydrophobicContact CG1-CD2 4.19Å; V492-R530 HydrophobicContact CG2-CB 4.09Å; V492-V535 HydrophobicContact CG1-CG1 4.01Å; V492-V535 HydrophobicContact CG2-CG1 4.44Å; V492-V535 HydrophobicContact CG2-CG2 4.27Å
493	Q	94.4	Very high	86	Confident	51 Å²	51	58.2 Å²	58.2	24%	0.238	31%	0.307	C	S	.	.	H	α-helix	trans	-61.3	-41.1	179	176.3	65	2.1	0	0	112.4	D489 Q490 N497 Y519	D489-Q493 PolarHBondContact O-N 3.3Å; Q490-Q493 PolarHBondContact O-N 2.93Å; Q493-N497 PolarHBondContact NE2-ND2 3.34Å; Q493-N497 WeakPolarHBondContact O-CB 3.36Å; Q493-N497 VanDerWaalsContact O-CG 3.22Å; Q493-N497 PolarHBondContact O-N 2.99Å; Q493-N497 PolarHBondContact O-ND2 3.05Å; Q493-Y519 WeakPolarHBondContact CA-OH 3.29Å; Q493-Y519 PolarHBondContact OE1-OH 2.94Å; Q493-Y519 VanDerWaalsContact OE1-OH 3.09Å
494	Q	94.3	Very high	87.7	Confident	116 Å²	116	59.3 Å²	59.3	54%	0.542	31%	0.312	S	S	.	.	H	α-helix	trans	-63.6	-46.2	176.6	-74.3	169.2	17.5	0	0	111.9	Q490 F491 V492 N497 K498	Q490-Q494 WeakPolarHBondContact O-CB 3.39Å; Q490-Q494 WeakPolarHBondContact O-CG 3.17Å; Q490-Q494 PolarHBondContact O-N 3.44Å; F491-Q494 PolarHBondContact O-N 3.39Å; V492-Q494 PolarHBondContact O-N 3.23Å; Q494-N497 PolarHBondContact O-N 3.3Å; Q494-K498 WeakPolarHBondContact O-CB 3.2Å; Q494-K498 PolarHBondContact O-N 3.44Å
495	Q	95.1	Very high	88.9	Confident	49 Å²	49	59.1 Å²	59.1	23%	0.229	31%	0.31	C	S	.	.	H	α-helix	trans	-67.6	-40.2	178.2	-64.6	-64.5	-7.5	0	0	111.9	F491 V492 K498 K499 V535 L546	F491-Q495 HydrophobicContact CD1-CG 4.19Å; F491-Q495 HydrophobicContact CD2-CG 4.45Å; F491-Q495 HydrophobicContact CE1-CG 3.83Å; F491-Q495 HydrophobicContact CE2-CG 4.11Å; F491-Q495 HydrophobicContact CZ-CG 3.78Å; F491-Q495 WeakPolarHBondContact O-CG 3.24Å; F491-Q495 PolarHBondContact O-N 3.06Å; V492-Q495 PolarHBondContact O-N 3.02Å; Q495-K498 PolarHBondContact O-N 3.05Å; Q495-K499 WeakPolarHBondContact O-CB 3.24Å; Q495-K499 VanDerWaalsContact O-CG 3.22Å; Q495-K499 WeakPolarHBondContact O-CG 3.4Å; Q495-K499 PolarHBondContact O-N 3.25Å; Q495-V535 HydrophobicContact CB-CG2 3.82Å; Q495-V535 HydrophobicContact CG-CG2 4.1Å; Q495-L546 HydrophobicContact CB-CD2 4.34Å
496	V	95.5	Very high	89.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-54.7	-55.8	172.8	164.7	0	0	0	0	110.6	V492 K498 K499 L500 M511 Y519 L528 L546	V492-V496 HydrophobicContact CG1-CG2 4.36Å; V492-V496 WeakPolarHBondContact O-CB 3.43Å; V492-V496 VanDerWaalsContact O-CG2 3.27Å; V492-V496 WeakPolarHBondContact O-CG2 3.49Å; V492-V496 PolarHBondContact O-N 3.41Å; V496-K498 PolarHBondContact O-N 2.99Å; V496-K499 PolarHBondContact O-N 2.89Å; V496-L500 HydrophobicContact CG1-CD1 3.67Å; V496-L500 HydrophobicContact CG1-CG 4.41Å; V496-L500 WeakPolarHBondContact O-CB 3.41Å; V496-L500 VanDerWaalsContact O-CG 3.27Å; V496-L500 WeakPolarHBondContact O-CG 3.31Å; V496-L500 PolarHBondContact O-N 2.83Å; V496-M511 HydrophobicContact CB-CE 4.39Å; V496-M511 HydrophobicContact CG1-CE 3.52Å; V496-M511 HydrophobicContact CG2-CE 3.93Å; V496-Y519 HydrophobicContact CB-CE1 4.38Å; V496-Y519 HydrophobicContact CG1-CD1 4.35Å; V496-Y519 HydrophobicContact CG1-CE1 3.92Å; V496-Y519 HydrophobicContact CG2-CE1 4.21Å; V496-L528 HydrophobicContact CG2-CD2 3.4Å; V496-L546 HydrophobicContact CG2-CD1 4.33Å; V496-L546 HydrophobicContact CG2-CD2 4Å
497	N	94.5	Very high	90.9	Very high	79 Å²	79	65 Å²	65	42%	0.422	36%	0.355	S	S	.	.	H	α-helix	trans	-63.4	-42.5	-178.3	-66.9	-21.6	0	0	0	111.9	Q493 Q494 K499 L500 A501	Q493-N497 PolarHBondContact NE2-ND2 3.34Å; Q493-N497 WeakPolarHBondContact O-CB 3.36Å; Q493-N497 VanDerWaalsContact O-CG 3.22Å; Q493-N497 PolarHBondContact O-N 2.99Å; Q493-N497 PolarHBondContact O-ND2 3.05Å; Q494-N497 PolarHBondContact O-N 3.3Å; N497-K499 PolarHBondContact O-N 3.06Å; N497-L500 PolarHBondContact O-N 3.26Å; N497-A501 VanDerWaalsContact O-CB 3.32Å; N497-A501 WeakPolarHBondContact O-CB 3.39Å; N497-A501 PolarHBondContact O-N 2.92Å
498	K	94.5	Very high	91.6	Very high	130 Å²	130	66.3 Å²	66.3	57%	0.565	35%	0.353	S	S	*	.	H	α-helix	trans	-59.5	-44.5	176.8	-178.9	-179.9	179.6	-178.9	0	112.3	Q494 Q495 V496 Q502	Q494-K498 WeakPolarHBondContact O-CB 3.2Å; Q494-K498 PolarHBondContact O-N 3.44Å; Q495-K498 PolarHBondContact O-N 3.05Å; V496-K498 PolarHBondContact O-N 2.99Å; K498-Q502 WeakPolarHBondContact O-CG 3Å
499	K	92.8	Very high	91.7	Very high	43 Å²	43	65.5 Å²	65.5	19%	0.187	35%	0.347	C	S	.	.	H	α-helix	trans	-73.3	-41.9	-179.7	-66.2	-73.1	-172.6	166.4	0	111.5	Q495 V496 N497 A501 Q502 L546 D547 L550 R557	Q495-K499 WeakPolarHBondContact O-CB 3.24Å; Q495-K499 VanDerWaalsContact O-CG 3.22Å; Q495-K499 WeakPolarHBondContact O-CG 3.4Å; Q495-K499 PolarHBondContact O-N 3.25Å; V496-K499 PolarHBondContact O-N 2.89Å; N497-K499 PolarHBondContact O-N 3.06Å; K499-A501 VanDerWaalsContact C-N 3.34Å; K499-A501 PolarHBondContact O-N 3.18Å; K499-Q502 WeakPolarHBondContact O-CB 3.42Å; K499-Q502 PolarHBondContact O-N 3.32Å; K499-L546 HydrophobicContact CB-CD2 4.31Å; K499-L546 HydrophobicContact CG-CD2 4.02Å; K499-D547 WeakPolarHBondContact CD-OD1 3.4Å; K499-D547 WeakPolarHBondContact CE-OD1 3.24Å; K499-D547 WeakPolarHBondContact CE-OD2 3.47Å; K499-D547 IonicContact NZ-OD1 3.87Å; K499-D547 PolarHBondContact NZ-OD1 2.83Å; K499-D547 IonicContact NZ-OD2 3.52Å; K499-D547 PolarHBondContact NZ-OD2 2.91Å; K499-L550 HydrophobicContact CB-CD1 3.52Å; K499-L550 HydrophobicContact CG-CD1 4.47Å; K499-R557 PolarHBondContact O-NH2 3.38Å
500	L	92.9	Very high	91.7	Very high	22 Å²	22	71.5 Å²	71.5	12%	0.115	37%	0.374	C	S	.	.	H	α-helix	trans	-63.9	-36.4	176.8	-69.7	174.4	0	0	0	112.7	V496 N497 Q502 C503 L509 M511 L550	V496-L500 HydrophobicContact CG1-CD1 3.67Å; V496-L500 HydrophobicContact CG1-CG 4.41Å; V496-L500 WeakPolarHBondContact O-CB 3.41Å; V496-L500 VanDerWaalsContact O-CG 3.27Å; V496-L500 WeakPolarHBondContact O-CG 3.31Å; V496-L500 PolarHBondContact O-N 2.83Å; N497-L500 PolarHBondContact O-N 3.26Å; L500-Q502 PolarHBondContact O-N 3.42Å; L500-C503 WeakPolarHBondContact O-CB 3.32Å; L500-C503 PolarHBondContact O-N 2.77Å; L500-L509 HydrophobicContact CD2-CB 4.32Å; L500-L509 HydrophobicContact CD2-CD2 4.12Å; L500-M511 HydrophobicContact CD1-CB 4.01Å; L500-M511 HydrophobicContact CD1-CE 4.5Å; L500-L550 HydrophobicContact CD2-CD2 3.65Å
501	A	92.1	Very high	91.8	Very high	67 Å²	67	67.4 Å²	67.4	55%	0.554	36%	0.355	S	S	*	.	H	α-helix	trans	-57.8	-30	176.9	0	0	0	0	0	113.3	N497 K499 C503 K508	N497-A501 VanDerWaalsContact O-CB 3.32Å; N497-A501 WeakPolarHBondContact O-CB 3.39Å; N497-A501 PolarHBondContact O-N 2.92Å; K499-A501 VanDerWaalsContact C-N 3.34Å; K499-A501 PolarHBondContact O-N 3.18Å; A501-C503 PolarHBondContact O-N 3.09Å; A501-K508 PolarHBondContact O-NZ 3.14Å
502	Q	91	Very high	91.8	Very high	97 Å²	97	69.7 Å²	69.7	45%	0.453	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-8.9	177.5	-59.1	165.6	-21.9	0	0	114.1	K498 K499 L500 T504	K498-Q502 WeakPolarHBondContact O-CG 3Å; K499-Q502 WeakPolarHBondContact O-CB 3.42Å; K499-Q502 PolarHBondContact O-N 3.32Å; L500-Q502 PolarHBondContact O-N 3.42Å; Q502-T504 PolarHBondContact O-N 3.24Å
503	C	91.4	Very high	91.7	Very high	2 Å²	2	73.6 Å²	73.6	1%	0.014	38%	0.381	C	S	.	.			trans	-63.4	126.8	176.1	178.4	0	0	0	0	110.3	L500 A501 K508 D554	L500-C503 WeakPolarHBondContact O-CB 3.32Å; L500-C503 PolarHBondContact O-N 2.77Å; A501-C503 PolarHBondContact O-N 3.09Å; C503-K508 HydrophobicContact CB-CB 4.46Å; C503-K508 HydrophobicContact CB-CD 4.33Å; C503-K508 HydrophobicContact CB-CG 4.35Å; C503-K508 WeakPolarHBondContact O-CE 3.37Å; C503-K508 PolarHBondContact O-NZ 2.91Å; C503-D554 WeakPolarHBondContact CB-OD2 3.38Å; C503-D554 PolarHBondContact SG-OD1 2.88Å
504	T	91.1	Very high	91.7	Very high	116 Å²	116	74.1 Å²	74.1	71%	0.712	39%	0.385	S	S	*	.			trans	-99.6	-2.1	179.8	57.3	0	0	0	0	113.7	Q502 C556	Q502-T504 PolarHBondContact O-N 3.24Å; T504-C556 PolarHBondContact N-SG 3.26Å; T504-C556 VanDerWaalsContact N-SG 3.41Å; T504-C556 WeakPolarHBondContact OG1-CB 3.23Å; T504-C556 PolarHBondContact OG1-SG 3.37Å
505	C	89.1	Confident	91.6	Very high	27 Å²	27	71.8 Å²	71.8	18%	0.182	37%	0.374	C	S	.	.	S	Bend	trans	-63	145.9	174.9	-64.8	0	0	0	0	112.1	N507 K508 C556	C505-N507 VanDerWaalsContact CB-O 3.3Å; C505-N507 WeakPolarHBondContact CB-O 3.2Å; C505-K508 VanDerWaalsContact O-CG 3.29Å; C505-K508 WeakPolarHBondContact O-CG 3.36Å; C505-C556 PolarHBondContact SG-N 2.87Å; C505-C556 VanDerWaalsContact SG-N 3.41Å
506	C	87.7	Confident	91.4	Very high	146 Å²	146	72.2 Å²	72.2	99%	0.986	38%	0.376	S	S	*	.	S	Bend	trans	-62	-42.2	172	52.7	0	0	0	0	112
507	N	85.9	Confident	91.3	Very high	135 Å²	135	72.3 Å²	72.3	72%	0.722	38%	0.377	S	S	*	.	S	Bend	trans	-96.1	98.5	164.9	-172.5	4.2	0	0	0	108.5	C505	C505-N507 VanDerWaalsContact CB-O 3.3Å; C505-N507 WeakPolarHBondContact CB-O 3.2Å
508	K	87.3	Confident	91.3	Very high	109 Å²	109	69.3 Å²	69.3	47%	0.474	36%	0.36	S	S	.	.			trans	-72.9	149.8	-178.1	-64.2	-162.9	-178.2	-146.3	0	111.5	A501 C503 C505 H510	A501-K508 PolarHBondContact O-NZ 3.14Å; C503-K508 HydrophobicContact CB-CB 4.46Å; C503-K508 HydrophobicContact CB-CD 4.33Å; C503-K508 HydrophobicContact CB-CG 4.35Å; C503-K508 WeakPolarHBondContact O-CE 3.37Å; C503-K508 PolarHBondContact O-NZ 2.91Å; C505-K508 VanDerWaalsContact O-CG 3.29Å; C505-K508 WeakPolarHBondContact O-CG 3.36Å; K508-H510 PolarHBondContact O-N 3.33Å
509	L	87.6	Confident	91.4	Very high	30 Å²	30	63.2 Å²	63.2	16%	0.157	33%	0.333	C	S	.	.			trans	-63.8	99.9	177.3	-167.1	77.2	0	0	0	111	L500 M511 L521 L550 H553 D554	L500-L509 HydrophobicContact CD2-CB 4.32Å; L500-L509 HydrophobicContact CD2-CD2 4.12Å; L509-M511 PolarHBondContact O-N 3.18Å; L509-L521 HydrophobicContact CD1-CD1 3.81Å; L509-L521 HydrophobicContact CD1-CD2 4.32Å; L509-L521 HydrophobicContact CD2-CD2 4.37Å; L509-L521 HydrophobicContact CG-CD1 3.96Å; L509-L550 HydrophobicContact CD2-CD2 3.47Å; L509-L550 VanDerWaalsContact CD2-CD2 3.47Å; L509-H553 HydrophobicContact CD1-CB 4.12Å; L509-H553 HydrophobicContact CD2-CB 4Å; L509-D554 HydrophobicContact CD2-CB 4.43Å
510	H	88.7	Confident	91.6	Very high	142 Å²	142	66.2 Å²	66.2	66%	0.657	34%	0.343	S	S	*	.			trans	-82.7	112.9	178.2	-177	85.8	0	0	0	111.2	K508 L521	K508-H510 PolarHBondContact O-N 3.33Å; H510-L521 VanDerWaalsContact O-CD1 3.22Å; H510-L521 WeakPolarHBondContact O-CD1 3.47Å
511	M	93.3	Very high	91.6	Very high	15 Å²	15	66.3 Å²	66.3	7%	0.074	34%	0.344	C	S	.	.			trans	-116.9	108.1	173.5	-172.9	166.2	77.9	0	0	109.7	V496 L500 L509 Y519 R520 L521 L528 F549	V496-M511 HydrophobicContact CB-CE 4.39Å; V496-M511 HydrophobicContact CG1-CE 3.52Å; V496-M511 HydrophobicContact CG2-CE 3.93Å; L500-M511 HydrophobicContact CD1-CB 4.01Å; L500-M511 HydrophobicContact CD1-CE 4.5Å; L509-M511 PolarHBondContact O-N 3.18Å; M511-Y519 HydrophobicContact CE-CD1 3.87Å; M511-Y519 HydrophobicContact CE-CG 4.06Å; M511-Y519 HydrophobicContact CG-CD1 4.18Å; M511-Y519 HydrophobicContact CG-CG 4.38Å; M511-Y519 HydrophobicContact SD-CG 4.42Å; M511-R520 CarbonylContact C-O 3.55Å; M511-R520 WeakPolarHBondContact CA-O 3.44Å; M511-L521 HydrophobicContact CG-CB 4.34Å; M511-L528 HydrophobicContact CE-CD2 4.02Å; M511-F549 HydrophobicContact SD-CE1 4.37Å
512	Q	92.9	Very high	91.4	Very high	84 Å²	84	66 Å²	66	39%	0.393	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	119.8	-177.7	179.7	-174.8	25.3	0	0	109.7	L514 Y519 R520	Q512-L514 HydrophobicContact CG-CD2 4.25Å; Q512-L514 PolarHBondContact O-N 3.01Å; Q512-Y519 CarbonylContact O-C 3.58Å; Q512-Y519 WeakPolarHBondContact O-CA 3.33Å; Q512-R520 HydrophobicContact CB-CB 4.35Å; Q512-R520 PolarHBondContact N-O 3.36Å; Q512-R520 PolarHBondContact O-N 3.21Å; Q512-R520 VanDerWaalsContact OE1-NH1 3.16Å
513	R	95	Very high	91.4	Very high	86 Å²	86	67.4 Å²	67.4	33%	0.325	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	131.8	164.9	-177.4	174.9	162.4	167.1	-5.7	109.5	D489 E515 Y519	D489-R513 VanDerWaalsContact CG-NH1 3.33Å; D489-R513 VanDerWaalsContact CG-NH2 3.27Å; D489-R513 IonicContact OD1-CZ 2.92Å; D489-R513 IonicContact OD1-NH1 2.7Å; D489-R513 PolarHBondContact OD1-NH1 3.3Å; D489-R513 IonicContact OD1-NH2 3.89Å; D489-R513 PolarHBondContact OD1-NH2 3.12Å; D489-R513 IonicContact OD2-CZ 3.37Å; D489-R513 IonicContact OD2-NH1 2.59Å; D489-R513 PolarHBondContact OD2-NH1 3.26Å; D489-R513 IonicContact OD2-NH2 3.34Å; D489-R513 PolarHBondContact OD2-NH2 3.21Å; R513-E515 VanDerWaalsContact CG-O 3.31Å; R513-E515 WeakPolarHBondContact CG-O 3.44Å; R513-E515 PolarHBondContact NE-O 3.39Å; R513-Y519 HydrophobicContact CB-CD1 3.86Å; R513-Y519 HydrophobicContact CB-CE1 3.61Å; R513-Y519 HydrophobicContact CG-CD1 4.34Å; R513-Y519 HydrophobicContact CG-CE1 3.89Å
514	L	93.4	Very high	91.4	Very high	62 Å²	62	75.2 Å²	75.2	33%	0.325	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-45.7	174.4	-60.5	-178.5	0	0	0	111.4	Q512 R518 R520 I525	Q512-L514 HydrophobicContact CG-CD2 4.25Å; Q512-L514 PolarHBondContact O-N 3.01Å; L514-R518 HydrophobicContact CB-CB 4.45Å; L514-R518 HydrophobicContact CB-CG 4.41Å; L514-R518 HydrophobicContact CD1-CG 4.19Å; L514-R518 PolarHBondContact N-O 3.24Å; L514-R520 HydrophobicContact CD1-CB 4.11Å; L514-R520 HydrophobicContact CD2-CB 4.12Å; L514-R520 HydrophobicContact CG-CB 4.12Å; L514-I525 HydrophobicContact CD1-CD1 4.02Å; L514-I525 HydrophobicContact CD1-CG1 4.18Å
515	E	91.8	Very high	91.5	Very high	66 Å²	66	73.2 Å²	73.2	31%	0.308	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	-162.1	-175.9	55.2	168.6	-135.2	0	0	109	H269 R513 G517 R518	H269-E515 IonicContact CE1-OE1 2.73Å; H269-E515 IonicContact CE1-OE2 3.57Å; H269-E515 PolarHBondContact CE1-OE2 3.39Å; H269-E515 IonicContact ND1-OE2 3.76Å; H269-E515 IonicContact NE2-OE2 3.92Å; R513-E515 VanDerWaalsContact CG-O 3.31Å; R513-E515 WeakPolarHBondContact CG-O 3.44Å; R513-E515 PolarHBondContact NE-O 3.39Å; E515-G517 PolarHBondContact O-N 3.21Å; E515-R518 HydrophobicContact CG-CB 3.41Å; E515-R518 VanDerWaalsContact CG-CB 3.41Å; E515-R518 HydrophobicContact CG-CG 4.3Å; E515-R518 PolarHBondContact O-N 2.71Å; E515-R518 IonicContact OE1-CZ 2.76Å; E515-R518 IonicContact OE1-NE 3.45Å; E515-R518 PolarHBondContact OE1-NE 2.87Å; E515-R518 IonicContact OE1-NH2 3.3Å; E515-R518 PolarHBondContact OE1-NH2 2.95Å; E515-R518 IonicContact OE2-CZ 3.33Å; E515-R518 IonicContact OE2-NE 2.75Å; E515-R518 IonicContact OE2-NH2 2.78Å
516	E	92.2	Very high	91.7	Very high	59 Å²	59	73 Å²	73	28%	0.276	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	116.9	175	174.1	172.1	160.4	0	0	112.6	K485 D489 R518	K485-E516 WeakPolarHBondContact CE-OE1 3.47Å; K485-E516 WeakPolarHBondContact CG-OE1 3.23Å; K485-E516 IonicContact NZ-OE1 3.32Å; K485-E516 PolarHBondContact NZ-OE1 2.96Å; K485-E516 IonicContact NZ-OE2 2.95Å; K485-E516 PolarHBondContact NZ-OE2 2.85Å; D489-E516 HydrophobicContact CB-CG 3.92Å; D489-E516 WeakPolarHBondContact OD1-CA 3.33Å; E516-R518 PolarHBondContact O-N 3.23Å
517	G	92.7	Very high	92.1	Very high	2 Å²	2	66.6 Å²	66.6	2%	0.021	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	-1.6	179	0	0	0	0	0	116.7	D489 E515 Y519 L528	D489-G517 PolarHBondContact OD1-N 3.34Å; E515-G517 PolarHBondContact O-N 3.21Å; G517-Y519 WeakPolarHBondContact O-CD2 3.3Å; G517-L528 WeakPolarHBondContact CA-O 3.42Å; G517-L528 PolarHBondContact O-N 2.96Å
518	R	95.1	Very high	92.6	Very high	16 Å²	16	60.2 Å²	60.2	6%	0.06	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.8	179.2	-167	-172	-54.7	-141.3	0	111.1	H269 L514 E515 E516 I525 Y527	H269-R518 PolarHBondContact CD2-NH2 3.43Å; H269-R518 PolarHBondContact CE1-NH2 2.88Å; H269-R518 VanDerWaalsContact CG-NH1 3.28Å; H269-R518 PolarHBondContact ND1-NH1 3.35Å; H269-R518 PolarHBondContact ND1-NH2 2.77Å; H269-R518 VanDerWaalsContact ND1-NH2 3.19Å; H269-R518 PolarHBondContact NE2-NH2 3.36Å; L514-R518 HydrophobicContact CB-CB 4.45Å; L514-R518 HydrophobicContact CB-CG 4.41Å; L514-R518 HydrophobicContact CD1-CG 4.19Å; L514-R518 PolarHBondContact N-O 3.24Å; E515-R518 HydrophobicContact CG-CB 3.41Å; E515-R518 VanDerWaalsContact CG-CB 3.41Å; E515-R518 HydrophobicContact CG-CG 4.3Å; E515-R518 PolarHBondContact O-N 2.71Å; E515-R518 IonicContact OE1-CZ 2.76Å; E515-R518 IonicContact OE1-NE 3.45Å; E515-R518 PolarHBondContact OE1-NE 2.87Å; E515-R518 IonicContact OE1-NH2 3.3Å; E515-R518 PolarHBondContact OE1-NH2 2.95Å; E515-R518 IonicContact OE2-CZ 3.33Å; E515-R518 IonicContact OE2-NE 2.75Å; E515-R518 IonicContact OE2-NH2 2.78Å; E516-R518 PolarHBondContact O-N 3.23Å; R518-I525 HydrophobicContact CG-CG2 3.45Å; R518-I525 VanDerWaalsContact CG-CG2 3.45Å; R518-Y527 HydrophobicContact CB-CD1 4.33Å; R518-Y527 HydrophobicContact CB-CE1 4.14Å; R518-Y527 HydrophobicContact CG-CD1 4.23Å; R518-Y527 HydrophobicContact CG-CE1 3.74Å; R518-Y527 PolarHBondContact NH1-OH 3.01Å
519	Y	96.4	Very high	93	Very high	1 Å²	1	56.1 Å²	56.1	0%	0.004	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	135.7	-175.3	-65.6	-99.1	0	0	0	111.3	V492 Q493 V496 M511 Q512 R513 G517 I525 Y526 L528	V492-Y519 HydrophobicContact CG1-CE2 4.01Å; Q493-Y519 WeakPolarHBondContact CA-OH 3.29Å; Q493-Y519 PolarHBondContact OE1-OH 2.94Å; Q493-Y519 VanDerWaalsContact OE1-OH 3.09Å; V496-Y519 HydrophobicContact CB-CE1 4.38Å; V496-Y519 HydrophobicContact CG1-CD1 4.35Å; V496-Y519 HydrophobicContact CG1-CE1 3.92Å; V496-Y519 HydrophobicContact CG2-CE1 4.21Å; M511-Y519 HydrophobicContact CE-CD1 3.87Å; M511-Y519 HydrophobicContact CE-CG 4.06Å; M511-Y519 HydrophobicContact CG-CD1 4.18Å; M511-Y519 HydrophobicContact CG-CG 4.38Å; M511-Y519 HydrophobicContact SD-CG 4.42Å; Q512-Y519 CarbonylContact O-C 3.58Å; Q512-Y519 WeakPolarHBondContact O-CA 3.33Å; R513-Y519 HydrophobicContact CB-CD1 3.86Å; R513-Y519 HydrophobicContact CB-CE1 3.61Å; R513-Y519 HydrophobicContact CG-CD1 4.34Å; R513-Y519 HydrophobicContact CG-CE1 3.89Å; G517-Y519 WeakPolarHBondContact O-CD2 3.3Å; Y519-I525 CarbonylContact O-C 3.53Å; Y519-I525 WeakPolarHBondContact O-CA 3.23Å; Y519-Y526 PolarHBondContact N-O 3.43Å; Y519-Y526 PolarHBondContact O-N 3.11Å; Y519-L528 HydrophobicContact CD2-CB 3.97Å; Y519-L528 HydrophobicContact CD2-CD1 3.82Å; Y519-L528 HydrophobicContact CD2-CD2 3.82Å; Y519-L528 HydrophobicContact CD2-CG 4.07Å; Y519-L528 HydrophobicContact CE2-CB 3.94Å; Y519-L528 HydrophobicContact CE2-CD2 3.9Å; Y519-L528 HydrophobicContact CE2-CG 4.34Å; Y519-L528 HydrophobicContact CG-CD1 4.35Å; Y519-L528 HydrophobicContact CG-CD2 4.35Å
520	R	95.6	Very high	93.3	Very high	106 Å²	106	58.3 Å²	58.3	40%	0.4	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	131.9	174.2	178.9	-174.3	-70.6	159.9	-9	110	M511 Q512 L514 G522 R524	M511-R520 CarbonylContact C-O 3.55Å; M511-R520 WeakPolarHBondContact CA-O 3.44Å; Q512-R520 HydrophobicContact CB-CB 4.35Å; Q512-R520 PolarHBondContact N-O 3.36Å; Q512-R520 PolarHBondContact O-N 3.21Å; Q512-R520 VanDerWaalsContact OE1-NH1 3.16Å; L514-R520 HydrophobicContact CD1-CB 4.11Å; L514-R520 HydrophobicContact CD2-CB 4.12Å; L514-R520 HydrophobicContact CG-CB 4.12Å; R520-G522 WeakPolarHBondContact CG-O 3.37Å; R520-R524 CarbonylContact C-O 3.57Å; R520-R524 WeakPolarHBondContact CA-O 3.34Å
521	L	92.7	Very high	93.7	Very high	24 Å²	24	52.1 Å²	52.1	13%	0.126	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	109.3	171.4	174.6	60.9	0	0	0	108.4	L509 H510 M511 S523 R524 Y526 F549 H553	L509-L521 HydrophobicContact CD1-CD1 3.81Å; L509-L521 HydrophobicContact CD1-CD2 4.32Å; L509-L521 HydrophobicContact CD2-CD2 4.37Å; L509-L521 HydrophobicContact CG-CD1 3.96Å; H510-L521 VanDerWaalsContact O-CD1 3.22Å; H510-L521 WeakPolarHBondContact O-CD1 3.47Å; M511-L521 HydrophobicContact CG-CB 4.34Å; L521-S523 PolarHBondContact O-N 3.43Å; L521-R524 PolarHBondContact N-O 3.34Å; L521-R524 PolarHBondContact O-N 2.62Å; L521-Y526 HydrophobicContact CB-CD2 4.11Å; L521-Y526 HydrophobicContact CB-CE2 3.92Å; L521-Y526 HydrophobicContact CD2-CE2 4.43Å; L521-F549 HydrophobicContact CD2-CE1 4.12Å; L521-F549 HydrophobicContact CD2-CZ 4.05Å; L521-H553 HydrophobicContact CD2-CB 4.39Å
522	G	89.5	Confident	93.6	Very high	62 Å²	62	54.8 Å²	54.8	64%	0.639	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	-132.3	-166.4	0	0	0	0	0	111.4	R520 R524	R520-G522 WeakPolarHBondContact CG-O 3.37Å; G522-R524 VanDerWaalsContact C-N 3.31Å
523	S	89.6	Confident	93.6	Very high	125 Å²	125	56.8 Å²	56.8	87%	0.874	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-1.3	175.5	55.7	0	0	0	0	114.5	L521	L521-S523 PolarHBondContact O-N 3.43Å
524	R	91.9	Very high	93.5	Very high	166 Å²	166	54.8 Å²	54.8	63%	0.626	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	143.9	-174.8	-69.1	-178.3	175.9	-168.8	-3.9	112	R520 L521 G522 Y526	R520-R524 CarbonylContact C-O 3.57Å; R520-R524 WeakPolarHBondContact CA-O 3.34Å; L521-R524 PolarHBondContact N-O 3.34Å; L521-R524 PolarHBondContact O-N 2.62Å; G522-R524 VanDerWaalsContact C-N 3.31Å; R524-Y526 HydrophobicContact CB-CD2 4.32Å; R524-Y526 HydrophobicContact CB-CE2 3.52Å; R524-Y526 WeakPolarHBondContact CD-OH 3.48Å
525	I	92.8	Very high	93.7	Very high	74 Å²	74	52.2 Å²	52.2	38%	0.379	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	138.8	171.2	-63.3	176.7	0	0	0	108.2	L514 R518 Y519 Y527	L514-I525 HydrophobicContact CD1-CD1 4.02Å; L514-I525 HydrophobicContact CD1-CG1 4.18Å; R518-I525 HydrophobicContact CG-CG2 3.45Å; R518-I525 VanDerWaalsContact CG-CG2 3.45Å; Y519-I525 CarbonylContact O-C 3.53Å; Y519-I525 WeakPolarHBondContact O-CA 3.23Å; I525-Y527 HydrophobicContact CG2-CE2 3.92Å
526	Y	94.5	Very high	93.9	Very high	23 Å²	23	49 Å²	49	9%	0.09	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	140	177.7	-63.2	-90.3	0	0	0	109	Y519 L521 R524 V537 V539 F549	Y519-Y526 PolarHBondContact N-O 3.43Å; Y519-Y526 PolarHBondContact O-N 3.11Å; L521-Y526 HydrophobicContact CB-CD2 4.11Å; L521-Y526 HydrophobicContact CB-CE2 3.92Å; L521-Y526 HydrophobicContact CD2-CE2 4.43Å; R524-Y526 HydrophobicContact CB-CD2 4.32Å; R524-Y526 HydrophobicContact CB-CE2 3.52Å; R524-Y526 WeakPolarHBondContact CD-OH 3.48Å; Y526-V537 HydrophobicContact CD1-CG1 4.25Å; Y526-V539 HydrophobicContact CD1-CG1 3.89Å; Y526-V539 HydrophobicContact CE1-CG1 3.91Å; Y526-F549 AromaticContact CD1-CE2 3.6Å; Y526-F549 HydrophobicContact CD1-CE2 3.6Å; Y526-F549 AromaticContact CD1-CZ 3.8Å; Y526-F549 HydrophobicContact CD1-CZ 3.8Å; Y526-F549 HydrophobicContact CD2-CZ 4.15Å; Y526-F549 AromaticContact CE1-CE2 3.45Å; Y526-F549 HydrophobicContact CE1-CE2 3.45Å; Y526-F549 VanDerWaalsContact CE1-CE2 3.45Å; Y526-F549 AromaticContact CE1-CZ 3.76Å; Y526-F549 HydrophobicContact CE1-CZ 3.76Å; Y526-F549 HydrophobicContact CE2-CZ 4.12Å; Y526-F549 HydrophobicContact CG-CE2 4.25Å; Y526-F549 AromaticContact CG-CZ 3.98Å; Y526-F549 HydrophobicContact CG-CZ 3.98Å; Y526-F549 AromaticContact CZ-CE2 4Å; Y526-F549 AromaticContact CZ-CZ 3.91Å
527	Y	95.1	Very high	94.1	Very high	12 Å²	12	46.2 Å²	46.2	5%	0.047	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	128.5	177.1	-66.5	-90.9	0	0	0	109.8	I262 E266 R518 I525 R538	I262-Y527 HydrophobicContact CG1-CG 4.48Å; I262-Y527 HydrophobicContact CG2-CD1 4.11Å; I262-Y527 HydrophobicContact CG2-CD2 3.73Å; I262-Y527 HydrophobicContact CG2-CE2 4.38Å; I262-Y527 HydrophobicContact CG2-CG 3.58Å; E266-Y527 HydrophobicContact CG-CD2 4.32Å; E266-Y527 HydrophobicContact CG-CE2 3.5Å; E266-Y527 WeakPolarHBondContact OE1-CE2 3.29Å; R518-Y527 HydrophobicContact CB-CD1 4.33Å; R518-Y527 HydrophobicContact CB-CE1 4.14Å; R518-Y527 HydrophobicContact CG-CD1 4.23Å; R518-Y527 HydrophobicContact CG-CE1 3.74Å; R518-Y527 PolarHBondContact NH1-OH 3.01Å; I525-Y527 HydrophobicContact CG2-CE2 3.92Å; Y527-R538 WeakPolarHBondContact O-CB 3.1Å; Y527-R538 PolarHBondContact O-N 3.2Å
528	L	96.6	Very high	94.2	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	135.4	-178.8	-81.6	67.1	0	0	0	108.8	V492 V496 M511 G517 Y519 V535 M536 V537 L546	V492-L528 HydrophobicContact CG1-CB 3.79Å; V492-L528 HydrophobicContact CG1-CD2 4.19Å; V496-L528 HydrophobicContact CG2-CD2 3.4Å; M511-L528 HydrophobicContact CE-CD2 4.02Å; G517-L528 WeakPolarHBondContact CA-O 3.42Å; G517-L528 PolarHBondContact O-N 2.96Å; Y519-L528 HydrophobicContact CD2-CB 3.97Å; Y519-L528 HydrophobicContact CD2-CD1 3.82Å; Y519-L528 HydrophobicContact CD2-CD2 3.82Å; Y519-L528 HydrophobicContact CD2-CG 4.07Å; Y519-L528 HydrophobicContact CE2-CB 3.94Å; Y519-L528 HydrophobicContact CE2-CD2 3.9Å; Y519-L528 HydrophobicContact CE2-CG 4.34Å; Y519-L528 HydrophobicContact CG-CD1 4.35Å; Y519-L528 HydrophobicContact CG-CD2 4.35Å; L528-V535 HydrophobicContact CB-CG1 4.21Å; L528-V535 HydrophobicContact CD2-CG1 3.98Å; L528-V535 HydrophobicContact CG-CG1 4.19Å; L528-M536 WeakPolarHBondContact CA-O 3.44Å; L528-V537 HydrophobicContact CD1-CB 4.46Å; L528-V537 HydrophobicContact CD1-CG1 3.87Å; L528-V537 HydrophobicContact CD1-CG2 4.25Å; L528-V537 HydrophobicContact CG-CG2 4.09Å; L528-L546 HydrophobicContact CD2-CD1 4.32Å
529	R	95.4	Very high	93.9	Very high	22 Å²	22	48 Å²	48	8%	0.083	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	152.3	173.8	-70.3	-69.7	-179.7	-99.4	13.4	109.8	M258 E261 I262 M536	M258-R529 HydrophobicContact CE-CB 4.44Å; M258-R529 HydrophobicContact SD-CB 3.38Å; M258-R529 WeakPolarHBondContact SD-CB 3.48Å; M258-R529 HydrophobicContact SD-CG 3.91Å; E261-R529 IonicContact OE1-CZ 3.22Å; E261-R529 IonicContact OE1-NE 3.09Å; E261-R529 PolarHBondContact OE1-NE 2.83Å; E261-R529 IonicContact OE1-NH2 3.32Å; E261-R529 PolarHBondContact OE1-NH2 2.83Å; E261-R529 IonicContact OE2-NE 2.69Å; I262-R529 HydrophobicContact CD1-CG 4.11Å; R529-M536 PolarHBondContact N-O 3.28Å; R529-M536 PolarHBondContact O-N 3.27Å
530	R	95.5	Very high	93.1	Very high	76 Å²	76	50.7 Å²	50.7	29%	0.287	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	139.7	170	-176.9	-178.4	175.5	-179.6	-1.4	109.2	T488 F491 V492 R532	T488-R530 HydrophobicContact CG2-CB 3.75Å; F491-R530 HydrophobicContact CD1-CB 4.27Å; F491-R530 HydrophobicContact CD1-CG 3.73Å; F491-R530 HydrophobicContact CE1-CG 3.86Å; V492-R530 HydrophobicContact CG2-CB 4.09Å; R530-R532 PolarHBondContact NE-O 3.37Å; R530-R532 VanDerWaalsContact NE-O 3.11Å
531	F	95.2	Very high	92.1	Very high	13 Å²	13	47.8 Å²	47.8	6%	0.057	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	119.5	165.9	-178.1	-128.9	0	0	0	110.1	V40 D44 Y254 L255 M258 N533 H534 M536	V40-F531 HydrophobicContact CG1-CD1 3.44Å; V40-F531 VanDerWaalsContact CG1-CD1 3.44Å; V40-F531 HydrophobicContact CG1-CE1 3.66Å; D44-F531 HydrophobicContact CB-CE1 3.91Å; D44-F531 HydrophobicContact CB-CZ 3.77Å; Y254-F531 AromaticContact CD1-CD2 3.22Å; Y254-F531 HydrophobicContact CD1-CD2 3.22Å; Y254-F531 AromaticContact CD1-CE2 3.44Å; Y254-F531 HydrophobicContact CD1-CE2 3.44Å; Y254-F531 VanDerWaalsContact CD1-CE2 3.44Å; Y254-F531 HydrophobicContact CD1-CG 4.18Å; Y254-F531 AromaticContact CE1-CD2 3.7Å; Y254-F531 HydrophobicContact CE1-CD2 3.7Å; Y254-F531 HydrophobicContact CE1-CE2 4.29Å; Y254-F531 AromaticContact CG-CD2 3.98Å; Y254-F531 HydrophobicContact CG-CD2 3.98Å; Y254-F531 AromaticContact CG-CE2 3.72Å; Y254-F531 HydrophobicContact CG-CE2 3.72Å; L255-F531 HydrophobicContact CD2-CD1 3.87Å; L255-F531 HydrophobicContact CD2-CE1 4.19Å; L255-F531 HydrophobicContact CD2-CG 4.33Å; L255-F531 HydrophobicContact CG-CD1 4.44Å; L255-F531 HydrophobicContact CG-CE1 4.26Å; M258-F531 HydrophobicContact CE-CB 4.18Å; F531-N533 PolarHBondContact O-N 2.72Å; F531-H534 PolarHBondContact N-O 3.45Å; F531-H534 PolarHBondContact O-N 3.14Å; F531-M536 HydrophobicContact CB-CG 3.76Å
532	R	91.6	Very high	91.9	Very high	71 Å²	71	47.3 Å²	47.3	27%	0.268	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	-110.2	-167.6	-53.6	-171.4	-173.2	103.4	4.6	111	E43 E47 R530	E43-R532 IonicContact OE2-CZ 3.79Å; E43-R532 IonicContact OE2-NH1 2.77Å; E43-R532 PolarHBondContact OE2-NH1 2.95Å; E47-R532 IonicContact OE2-CZ 2.72Å; E47-R532 IonicContact OE2-NE 2.45Å; E47-R532 IonicContact OE2-NH2 3.07Å; E47-R532 PolarHBondContact OE2-NH2 3.09Å; R530-R532 PolarHBondContact NE-O 3.37Å; R530-R532 VanDerWaalsContact NE-O 3.11Å
533	N	92.3	Very high	92.1	Very high	126 Å²	126	44.8 Å²	44.8	67%	0.674	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-5.2	178.4	-66.8	-25.3	0	0	0	114	F531	F531-N533 PolarHBondContact O-N 2.72Å
534	H	94.6	Very high	92.4	Very high	44 Å²	44	39.3 Å²	39.3	20%	0.204	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	156.3	-175.8	-50.8	-97.1	0	0	0	110.8	E36 F531 M536	E36-H534 IonicContact OE1-CE1 3.68Å; E36-H534 PolarHBondContact OE1-CE1 3.03Å; E36-H534 IonicContact OE1-ND1 3.61Å; F531-H534 PolarHBondContact N-O 3.45Å; F531-H534 PolarHBondContact O-N 3.14Å; H534-M536 HydrophobicContact CB-SD 3.86Å
535	V	96.9	Very high	92.6	Very high	7 Å²	7	31.6 Å²	31.6	4%	0.042	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	123.4	160.5	175.7	0	0	0	0	106.9	F491 V492 Q495 L528 T545 L546	F491-V535 HydrophobicContact CD1-CG2 4.2Å; F491-V535 HydrophobicContact CE1-CG2 3.87Å; V492-V535 HydrophobicContact CG1-CG1 4.01Å; V492-V535 HydrophobicContact CG2-CG1 4.44Å; V492-V535 HydrophobicContact CG2-CG2 4.27Å; Q495-V535 HydrophobicContact CB-CG2 3.82Å; Q495-V535 HydrophobicContact CG-CG2 4.1Å; L528-V535 HydrophobicContact CB-CG1 4.21Å; L528-V535 HydrophobicContact CD2-CG1 3.98Å; L528-V535 HydrophobicContact CG-CG1 4.19Å; V535-T545 CarbonylContact O-C 3.52Å; V535-L546 HydrophobicContact CB-CB 3.95Å; V535-L546 HydrophobicContact CB-CD2 4.19Å; V535-L546 HydrophobicContact CG1-CB 4.13Å; V535-L546 HydrophobicContact CG1-CD2 4.29Å; V535-L546 PolarHBondContact O-N 3.49Å
536	M	96.6	Very high	92.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.2	-179	-55.1	-54.7	-70	0	0	109.5	V40 L255 L528 R529 F531 H534 W543 L544 T545	V40-M536 HydrophobicContact CB-CE 4.23Å; V40-M536 HydrophobicContact CG1-CE 3.84Å; V40-M536 HydrophobicContact CG1-SD 3.9Å; L255-M536 HydrophobicContact CD2-CE 4.46Å; L255-M536 HydrophobicContact CD2-CG 4.31Å; L528-M536 WeakPolarHBondContact CA-O 3.44Å; R529-M536 PolarHBondContact N-O 3.28Å; R529-M536 PolarHBondContact O-N 3.27Å; F531-M536 HydrophobicContact CB-CG 3.76Å; H534-M536 HydrophobicContact CB-SD 3.86Å; M536-W543 HydrophobicContact CB-CD2 4.45Å; M536-W543 HydrophobicContact CB-CE3 3.59Å; M536-W543 HydrophobicContact CB-CZ3 3.89Å; M536-W543 HydrophobicContact CE-CB 4.06Å; M536-L544 CarbonylContact C-O 3.49Å; M536-L544 WeakPolarHBondContact CA-O 3.36Å; M536-T545 HydrophobicContact CE-CG2 4.27Å; M536-T545 HydrophobicContact SD-CG2 3.95Å
537	V	95.7	Very high	92.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.4	176.1	-168.8	0	0	0	0	108.6	Y526 L528 V539 L544 L546 F549	Y526-V537 HydrophobicContact CD1-CG1 4.25Å; L528-V537 HydrophobicContact CD1-CB 4.46Å; L528-V537 HydrophobicContact CD1-CG1 3.87Å; L528-V537 HydrophobicContact CD1-CG2 4.25Å; L528-V537 HydrophobicContact CG-CG2 4.09Å; V537-V539 HydrophobicContact CG1-CG1 4.15Å; V537-V539 PolarHBondContact O-N 3.27Å; V537-L544 PolarHBondContact N-O 3.03Å; V537-L544 PolarHBondContact O-N 2.9Å; V537-L546 HydrophobicContact CG2-CB 4.35Å; V537-L546 HydrophobicContact CG2-CD1 4.29Å; V537-F549 HydrophobicContact CB-CB 4.18Å; V537-F549 HydrophobicContact CB-CD2 4.14Å; V537-F549 HydrophobicContact CB-CG 4.13Å; V537-F549 HydrophobicContact CG1-CD1 4.42Å; V537-F549 HydrophobicContact CG1-CD2 3.68Å; V537-F549 HydrophobicContact CG1-CE2 3.86Å; V537-F549 HydrophobicContact CG1-CG 3.97Å; V537-F549 HydrophobicContact CG1-CZ 4.32Å; V537-F549 HydrophobicContact CG2-CB 3.74Å; V537-F549 HydrophobicContact CG2-CD1 4.2Å; V537-F549 HydrophobicContact CG2-CD2 4.37Å; V537-F549 HydrophobicContact CG2-CG 3.86Å
538	R	93.8	Very high	92.6	Very high	16 Å²	16	31.3 Å²	31.3	6%	0.06	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	121.3	174.3	-171.5	74.7	179.8	77.5	17.7	109.5	R121 I262 D263 Y527 G540 G542 W543	R121-R538 PolarHBondContact O-NH2 2.97Å; I262-R538 HydrophobicContact CD1-CB 3.94Å; I262-R538 HydrophobicContact CD1-CG 4.06Å; I262-R538 HydrophobicContact CG2-CG 4.33Å; D263-R538 IonicContact OD1-NH2 3.64Å; Y527-R538 WeakPolarHBondContact O-CB 3.1Å; Y527-R538 PolarHBondContact O-N 3.2Å; R538-G540 PolarHBondContact NH1-O 3.44Å; R538-G542 PolarHBondContact NH1-O 3.29Å; R538-W543 HydrophobicContact CB-CE3 4.22Å; R538-W543 HydrophobicContact CB-CH2 4.3Å; R538-W543 HydrophobicContact CB-CZ3 3.89Å
539	V	89.1	Confident	92.5	Very high	40 Å²	40	31.2 Å²	31.2	24%	0.242	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	106.8	-179.4	-76.2	0	0	0	0	112.2	Y526 V537 G541 G542 L544 F549	Y526-V539 HydrophobicContact CD1-CG1 3.89Å; Y526-V539 HydrophobicContact CE1-CG1 3.91Å; V537-V539 HydrophobicContact CG1-CG1 4.15Å; V537-V539 PolarHBondContact O-N 3.27Å; V539-G541 PolarHBondContact O-N 3.17Å; V539-G542 PolarHBondContact N-O 2.9Å; V539-G542 PolarHBondContact O-N 3.26Å; V539-G542 VanDerWaalsContact O-N 3.08Å; V539-L544 HydrophobicContact CG2-CB 4.32Å; V539-L544 HydrophobicContact CG2-CD1 3.8Å; V539-L544 HydrophobicContact CG2-CG 3.64Å; V539-F549 HydrophobicContact CG1-CD2 4.03Å; V539-F549 HydrophobicContact CG1-CE2 3.97Å
540	G	80.7	Confident	92.4	Very high	56 Å²	56	30.2 Å²	30.2	58%	0.577	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.2	-113.8	172.8	0	0	0	0	0	112.7	G122 R538 G542	G122-G540 WeakPolarHBondContact CA-O 3.24Å; R538-G540 PolarHBondContact NH1-O 3.44Å; G540-G542 PolarHBondContact O-N 3.06Å; G540-G542 VanDerWaalsContact O-N 3.13Å
541	G	74.7	Confident	92.2	Very high	46 Å²	46	30.5 Å²	30.5	47%	0.474	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-4.7	-179.3	0	0	0	0	0	117.2	G122 R242 V539	G122-G541 CarbonylContact O-C 3.59Å; G122-G541 WeakPolarHBondContact O-CA 3.35Å; R242-G541 PolarHBondContact NH1-O 2.9Å; R242-G541 PolarHBondContact NH2-O 2.89Å; V539-G541 PolarHBondContact O-N 3.17Å
542	G	87.2	Confident	91.9	Very high	14 Å²	14	34 Å²	34	14%	0.144	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.4	-133	180	0	0	0	0	0	115.1	R538 V539 G540	R538-G542 PolarHBondContact NH1-O 3.29Å; V539-G542 PolarHBondContact N-O 2.9Å; V539-G542 PolarHBondContact O-N 3.26Å; V539-G542 VanDerWaalsContact O-N 3.08Å; G540-G542 PolarHBondContact O-N 3.06Å; G540-G542 VanDerWaalsContact O-N 3.13Å
543	W	94.5	Very high	91.8	Very high	9 Å²	9	33.4 Å²	33.4	3%	0.034	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	145.8	-167.9	-64.8	97.3	0	0	0	112.4	L255 M258 E259 I262 M536 R538	L255-W543 HydrophobicContact CD2-CD2 4.35Å; L255-W543 HydrophobicContact CD2-CG 4.3Å; L255-W543 WeakPolarHBondContact O-CZ2 3.21Å; L255-W543 PolarHBondContact O-NE1 3.46Å; M258-W543 HydrophobicContact CB-CH2 3.73Å; M258-W543 HydrophobicContact CB-CZ2 3.65Å; M258-W543 HydrophobicContact CE-CH2 3.94Å; M258-W543 HydrophobicContact CE-CZ2 4.09Å; M258-W543 HydrophobicContact CE-CZ3 4.43Å; M258-W543 HydrophobicContact SD-CH2 4.44Å; E259-W543 HydrophobicContact CG-CZ2 3.73Å; E259-W543 VanDerWaalsContact CG-NE1 3.28Å; E259-W543 PolarHBondContact OE1-NE1 3.38Å; I262-W543 HydrophobicContact CD1-CH2 3.49Å; I262-W543 VanDerWaalsContact CD1-CH2 3.49Å; I262-W543 HydrophobicContact CD1-CZ2 4.31Å; I262-W543 HydrophobicContact CD1-CZ3 4.15Å; M536-W543 HydrophobicContact CB-CD2 4.45Å; M536-W543 HydrophobicContact CB-CE3 3.59Å; M536-W543 HydrophobicContact CB-CZ3 3.89Å; M536-W543 HydrophobicContact CE-CB 4.06Å; R538-W543 HydrophobicContact CB-CE3 4.22Å; R538-W543 HydrophobicContact CB-CH2 4.3Å; R538-W543 HydrophobicContact CB-CZ3 3.89Å
544	L	95.3	Very high	91.6	Very high	10 Å²	10	27.4 Å²	27.4	5%	0.052	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	155.4	163.7	-63.1	176	0	0	0	109.8	S37 M536 V537 V539 E548 F549	S37-L544 WeakPolarHBondContact OG-CA 3.23Å; M536-L544 CarbonylContact C-O 3.49Å; M536-L544 WeakPolarHBondContact CA-O 3.36Å; V537-L544 PolarHBondContact N-O 3.03Å; V537-L544 PolarHBondContact O-N 2.9Å; V539-L544 HydrophobicContact CG2-CB 4.32Å; V539-L544 HydrophobicContact CG2-CD1 3.8Å; V539-L544 HydrophobicContact CG2-CG 3.64Å; L544-E548 HydrophobicContact CB-CB 4.47Å; L544-E548 HydrophobicContact CB-CG 4.49Å; L544-E548 HydrophobicContact CD2-CG 3.9Å; L544-F549 HydrophobicContact CB-CB 4.41Å
545	T	96.4	Very high	91.4	Very high	3 Å²	3	28.5 Å²	28.5	2%	0.018	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	155.6	160.7	61.8	0	0	0	0	110.4	E36 S37 V40 V535 M536 D547 E548 F549	E36-T545 HydrophobicContact CB-CG2 4.41Å; E36-T545 HydrophobicContact CG-CG2 3.85Å; S37-T545 PolarHBondContact OG-N 3.07Å; V40-T545 HydrophobicContact CG2-CG2 4.31Å; V535-T545 CarbonylContact O-C 3.52Å; M536-T545 HydrophobicContact CE-CG2 4.27Å; M536-T545 HydrophobicContact SD-CG2 3.95Å; T545-D547 PolarHBondContact O-N 2.96Å; T545-E548 PolarHBondContact O-N 2.81Å; T545-E548 WeakPolarHBondContact OG1-CB 3.32Å; T545-E548 PolarHBondContact OG1-N 2.9Å; T545-F549 WeakPolarHBondContact O-CB 3.45Å; T545-F549 PolarHBondContact O-N 2.89Å
546	L	96	Very high	91.1	Very high	5 Å²	5	30.6 Å²	30.6	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-55.7	-37.5	173.6	175.5	63.6	0	0	0	111.9	Q495 V496 K499 L528 V535 V537 L550	Q495-L546 HydrophobicContact CB-CD2 4.34Å; V496-L546 HydrophobicContact CG2-CD1 4.33Å; V496-L546 HydrophobicContact CG2-CD2 4Å; K499-L546 HydrophobicContact CB-CD2 4.31Å; K499-L546 HydrophobicContact CG-CD2 4.02Å; L528-L546 HydrophobicContact CD2-CD1 4.32Å; V535-L546 HydrophobicContact CB-CB 3.95Å; V535-L546 HydrophobicContact CB-CD2 4.19Å; V535-L546 HydrophobicContact CG1-CB 4.13Å; V535-L546 HydrophobicContact CG1-CD2 4.29Å; V535-L546 PolarHBondContact O-N 3.49Å; V537-L546 HydrophobicContact CG2-CB 4.35Å; V537-L546 HydrophobicContact CG2-CD1 4.29Å; L546-L550 HydrophobicContact CD1-CD1 4.01Å; L546-L550 HydrophobicContact CD1-CG 4.12Å; L546-L550 HydrophobicContact CG-CD1 4.05Å; L546-L550 WeakPolarHBondContact O-CB 3.38Å; L546-L550 WeakPolarHBondContact O-CG 3.49Å; L546-L550 PolarHBondContact O-N 3.15Å
547	D	94	Very high	90.7	Very high	51 Å²	51	32.6 Å²	32.6	27%	0.273	19%	0.192	S	C	.	.	H	α-helix	trans	-61.9	-53.2	174.2	-79	-74.5	0	0	0	112	K499 T545 F549 L550 H551	K499-D547 WeakPolarHBondContact CD-OD1 3.4Å; K499-D547 WeakPolarHBondContact CE-OD1 3.24Å; K499-D547 WeakPolarHBondContact CE-OD2 3.47Å; K499-D547 IonicContact NZ-OD1 3.87Å; K499-D547 PolarHBondContact NZ-OD1 2.83Å; K499-D547 IonicContact NZ-OD2 3.52Å; K499-D547 PolarHBondContact NZ-OD2 2.91Å; T545-D547 PolarHBondContact O-N 2.96Å; D547-F549 VanDerWaalsContact C-N 3.29Å; D547-F549 PolarHBondContact O-N 2.89Å; D547-L550 PolarHBondContact O-N 3.4Å; D547-L550 VanDerWaalsContact O-N 3.12Å; D547-H551 PolarHBondContact O-N 3.22Å; D547-H551 PolarHBondContact O-ND1 3.41Å
548	E	93	Very high	89.6	Confident	47 Å²	47	38.7 Å²	38.7	22%	0.22	22%	0.215	C	C	.	.	H	α-helix	trans	-64.4	-35.1	-179.9	-179.9	54.4	-152.8	0	0	112	L544 T545 H551 R552	L544-E548 HydrophobicContact CB-CB 4.47Å; L544-E548 HydrophobicContact CB-CG 4.49Å; L544-E548 HydrophobicContact CD2-CG 3.9Å; T545-E548 PolarHBondContact O-N 2.81Å; T545-E548 WeakPolarHBondContact OG1-CB 3.32Å; T545-E548 PolarHBondContact OG1-N 2.9Å; E548-H551 PolarHBondContact O-N 2.9Å; E548-R552 WeakPolarHBondContact O-CG 3.48Å; E548-R552 PolarHBondContact O-N 2.92Å; E548-R552 IonicContact OE1-CZ 3.63Å; E548-R552 IonicContact OE1-NE 3.73Å; E548-R552 PolarHBondContact OE1-NE 3.18Å; E548-R552 IonicContact OE1-NH2 2.73Å; E548-R552 PolarHBondContact OE1-NH2 2.95Å
549	F	94.5	Very high	88.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-46	171.1	179.3	-97.4	0	0	0	112	M511 L521 Y526 V537 V539 L544 T545 D547 R552 H553	M511-F549 HydrophobicContact SD-CE1 4.37Å; L521-F549 HydrophobicContact CD2-CE1 4.12Å; L521-F549 HydrophobicContact CD2-CZ 4.05Å; Y526-F549 AromaticContact CD1-CE2 3.6Å; Y526-F549 HydrophobicContact CD1-CE2 3.6Å; Y526-F549 AromaticContact CD1-CZ 3.8Å; Y526-F549 HydrophobicContact CD1-CZ 3.8Å; Y526-F549 HydrophobicContact CD2-CZ 4.15Å; Y526-F549 AromaticContact CE1-CE2 3.45Å; Y526-F549 HydrophobicContact CE1-CE2 3.45Å; Y526-F549 VanDerWaalsContact CE1-CE2 3.45Å; Y526-F549 AromaticContact CE1-CZ 3.76Å; Y526-F549 HydrophobicContact CE1-CZ 3.76Å; Y526-F549 HydrophobicContact CE2-CZ 4.12Å; Y526-F549 HydrophobicContact CG-CE2 4.25Å; Y526-F549 AromaticContact CG-CZ 3.98Å; Y526-F549 HydrophobicContact CG-CZ 3.98Å; Y526-F549 AromaticContact CZ-CE2 4Å; Y526-F549 AromaticContact CZ-CZ 3.91Å; V537-F549 HydrophobicContact CB-CB 4.18Å; V537-F549 HydrophobicContact CB-CD2 4.14Å; V537-F549 HydrophobicContact CB-CG 4.13Å; V537-F549 HydrophobicContact CG1-CD1 4.42Å; V537-F549 HydrophobicContact CG1-CD2 3.68Å; V537-F549 HydrophobicContact CG1-CE2 3.86Å; V537-F549 HydrophobicContact CG1-CG 3.97Å; V537-F549 HydrophobicContact CG1-CZ 4.32Å; V537-F549 HydrophobicContact CG2-CB 3.74Å; V537-F549 HydrophobicContact CG2-CD1 4.2Å; V537-F549 HydrophobicContact CG2-CD2 4.37Å; V537-F549 HydrophobicContact CG2-CG 3.86Å; V539-F549 HydrophobicContact CG1-CD2 4.03Å; V539-F549 HydrophobicContact CG1-CE2 3.97Å; L544-F549 HydrophobicContact CB-CB 4.41Å; T545-F549 WeakPolarHBondContact O-CB 3.45Å; T545-F549 PolarHBondContact O-N 2.89Å; D547-F549 VanDerWaalsContact C-N 3.29Å; D547-F549 PolarHBondContact O-N 2.89Å; F549-R552 PolarHBondContact O-N 2.76Å; F549-H553 AromaticContact CD2-CE1 3.63Å; F549-H553 AromaticContact CD2-ND1 3.85Å; F549-H553 AromaticContact CE1-ND1 3.95Å; F549-H553 AromaticContact CE2-CE1 3.22Å; F549-H553 WeakPolarHBondContact CE2-CE1 3.5Å; F549-H553 AromaticContact CE2-ND1 3.68Å; F549-H553 AromaticContact CZ-CE1 3.58Å; F549-H553 AromaticContact CZ-ND1 3.74Å; F549-H553 PolarHBondContact O-N 2.75Å; F549-H553 PolarHBondContact O-ND1 3.49Å
550	L	93.8	Very high	86.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-68.5	-37.7	178.7	-71.4	173.3	0	0	0	112	K499 L500 L509 L546 D547 R552 H553 D554	K499-L550 HydrophobicContact CB-CD1 3.52Å; K499-L550 HydrophobicContact CG-CD1 4.47Å; L500-L550 HydrophobicContact CD2-CD2 3.65Å; L509-L550 HydrophobicContact CD2-CD2 3.47Å; L509-L550 VanDerWaalsContact CD2-CD2 3.47Å; L546-L550 HydrophobicContact CD1-CD1 4.01Å; L546-L550 HydrophobicContact CD1-CG 4.12Å; L546-L550 HydrophobicContact CG-CD1 4.05Å; L546-L550 WeakPolarHBondContact O-CB 3.38Å; L546-L550 WeakPolarHBondContact O-CG 3.49Å; L546-L550 PolarHBondContact O-N 3.15Å; D547-L550 PolarHBondContact O-N 3.4Å; D547-L550 VanDerWaalsContact O-N 3.12Å; L550-R552 PolarHBondContact O-N 2.82Å; L550-R552 VanDerWaalsContact O-N 3.15Å; L550-H553 PolarHBondContact O-N 2.95Å; L550-H553 VanDerWaalsContact O-N 3.11Å; L550-D554 WeakPolarHBondContact O-CB 3.49Å; L550-D554 PolarHBondContact O-N 2.87Å
551	H	90.3	Very high	84.5	Confident	83 Å²	83	51.5 Å²	51.5	38%	0.384	28%	0.277	S	S	.	.	H	α-helix	trans	-57.6	-27.2	173.4	-76	88.3	0	0	0	113	D547 E548 R558	D547-H551 PolarHBondContact O-N 3.22Å; D547-H551 PolarHBondContact O-ND1 3.41Å; E548-H551 PolarHBondContact O-N 2.9Å; H551-R558 WeakPolarHBondContact O-CG 3.47Å
552	R	88.6	Confident	82.6	Confident	87 Å²	87	54.2 Å²	54.2	33%	0.328	29%	0.289	S	S	.	.	H	α-helix	trans	-84.4	-24.4	177.7	-64.9	172	-168.5	-157.5	3.8	114	E548 F549 L550 R558	E548-R552 WeakPolarHBondContact O-CG 3.48Å; E548-R552 PolarHBondContact O-N 2.92Å; E548-R552 IonicContact OE1-CZ 3.63Å; E548-R552 IonicContact OE1-NE 3.73Å; E548-R552 PolarHBondContact OE1-NE 3.18Å; E548-R552 IonicContact OE1-NH2 2.73Å; E548-R552 PolarHBondContact OE1-NH2 2.95Å; F549-R552 PolarHBondContact O-N 2.76Å; L550-R552 PolarHBondContact O-N 2.82Å; L550-R552 VanDerWaalsContact O-N 3.15Å; R552-R558 PolarHBondContact O-NE 3.27Å
553	H	89.3	Confident	80.1	Confident	57 Å²	57	63.5 Å²	63.5	26%	0.264	33%	0.326	S	S	.	.	H	α-helix	trans	-109	-43.7	-173.4	-63.5	87.5	0	0	0	113.2	L509 L521 F549 L550 P555 R558	L509-H553 HydrophobicContact CD1-CB 4.12Å; L509-H553 HydrophobicContact CD2-CB 4Å; L521-H553 HydrophobicContact CD2-CB 4.39Å; F549-H553 AromaticContact CD2-CE1 3.63Å; F549-H553 AromaticContact CD2-ND1 3.85Å; F549-H553 AromaticContact CE1-ND1 3.95Å; F549-H553 AromaticContact CE2-CE1 3.22Å; F549-H553 WeakPolarHBondContact CE2-CE1 3.5Å; F549-H553 AromaticContact CE2-ND1 3.68Å; F549-H553 AromaticContact CZ-CE1 3.58Å; F549-H553 AromaticContact CZ-ND1 3.74Å; F549-H553 PolarHBondContact O-N 2.75Å; F549-H553 PolarHBondContact O-ND1 3.49Å; L550-H553 PolarHBondContact O-N 2.95Å; L550-H553 VanDerWaalsContact O-N 3.11Å; H553-P555 WeakPolarHBondContact O-CD 3.39Å; H553-R558 PolarHBondContact O-NH2 3.3Å
554	D	89.8	Confident	77.3	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.362	C	S	.	.			trans	-70.8	116.2	-179.5	-166.2	-12.5	0	0	0	110.4	C503 L509 L550 C556 R557	C503-D554 WeakPolarHBondContact CB-OD2 3.38Å; C503-D554 PolarHBondContact SG-OD1 2.88Å; L509-D554 HydrophobicContact CD2-CB 4.43Å; L550-D554 WeakPolarHBondContact O-CB 3.49Å; L550-D554 PolarHBondContact O-N 2.87Å; D554-C556 VanDerWaalsContact C-N 3.34Å; D554-C556 PolarHBondContact O-N 3.29Å; D554-C556 PolarHBondContact OD1-SG 2.84Å; D554-R557 HydrophobicContact CB-CB 4.35Å; D554-R557 HydrophobicContact CB-CG 4.09Å; D554-R557 PolarHBondContact O-N 2.76Å; D554-R557 IonicContact OD2-CZ 2.69Å; D554-R557 IonicContact OD2-NE 3.55Å; D554-R557 PolarHBondContact OD2-NE 3.04Å; D554-R557 IonicContact OD2-NH2 2.64Å; D554-R557 PolarHBondContact OD2-NH2 2.97Å
555	P	88.7	Confident	74.6	Confident	68 Å²	68	75.4 Å²	75.4	44%	0.442	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-61.3	-37.6	-174.7	-21.9	32.2	0	0	0	113.6	H553 R557 R558	H553-P555 WeakPolarHBondContact O-CD 3.39Å; P555-R557 PolarHBondContact O-N 3.38Å; P555-R558 PolarHBondContact O-N 3.07Å
556	C	90.4	Very high	71.5	Confident	50 Å²	50	83.9 Å²	83.9	34%	0.338	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-69.7	-15.8	-177.9	67.7	0	0	0	0	113.7	T504 C505 D554	T504-C556 PolarHBondContact N-SG 3.26Å; T504-C556 VanDerWaalsContact N-SG 3.41Å; T504-C556 WeakPolarHBondContact OG1-CB 3.23Å; T504-C556 PolarHBondContact OG1-SG 3.37Å; C505-C556 PolarHBondContact SG-N 2.87Å; C505-C556 VanDerWaalsContact SG-N 3.41Å; D554-C556 VanDerWaalsContact C-N 3.34Å; D554-C556 PolarHBondContact O-N 3.29Å; D554-C556 PolarHBondContact OD1-SG 2.84Å
557	R	89.4	Confident	68.8	Low	42 Å²	42	89 Å²	89	16%	0.158	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-91.2	-10.5	176.8	-61.3	-174.5	-148.4	-113.6	-9.1	113.5	K499 D554 P555 G559	K499-R557 PolarHBondContact O-NH2 3.38Å; D554-R557 HydrophobicContact CB-CB 4.35Å; D554-R557 HydrophobicContact CB-CG 4.09Å; D554-R557 PolarHBondContact O-N 2.76Å; D554-R557 IonicContact OD2-CZ 2.69Å; D554-R557 IonicContact OD2-NE 3.55Å; D554-R557 PolarHBondContact OD2-NE 3.04Å; D554-R557 IonicContact OD2-NH2 2.64Å; D554-R557 PolarHBondContact OD2-NH2 2.97Å; P555-R557 PolarHBondContact O-N 3.38Å; R557-G559 PolarHBondContact O-N 3.42Å
558	R	72.4	Confident	66.1	Low	129 Å²	129	90.9 Å²	90.9	49%	0.487	49%	0.491	S	S	.	.	S	Bend	trans	-79.5	11.1	-177.6	-77.2	-175.2	-95.7	156.4	-10	114.8	H551 R552 H553 P555 I560	H551-R558 WeakPolarHBondContact O-CG 3.47Å; R552-R558 PolarHBondContact O-NE 3.27Å; H553-R558 PolarHBondContact O-NH2 3.3Å; P555-R558 PolarHBondContact O-N 3.07Å; R558-I560 PolarHBondContact O-N 3.38Å; R558-I560 VanDerWaalsContact O-N 3.11Å
559	G	61.4	Low	63.5	Low	62 Å²	62	92.9 Å²	92.9	64%	0.639	52%	0.515	S	S	*	.			trans	69.7	6.6	170.7	0	0	0	0	0	115.7	R557 H561	R557-G559 PolarHBondContact O-N 3.42Å; G559-H561 PolarHBondContact O-N 2.83Å
560	I	50	Low	61	Low	144 Å²	144	98.7 Å²	98.7	74%	0.738	55%	0.551	S	S	*	*			trans	-77.5	73.6	175.6	-47.4	180	0	0	0	109.3	R558	R558-I560 PolarHBondContact O-N 3.38Å; R558-I560 VanDerWaalsContact O-N 3.11Å
561	H	44.9	Very low	58.5	Low	174 Å²	174	103 Å²	103	81%	0.806	58%	0.581	S	S	*	*			trans	-69.6	132.1	143	-83.3	-95.4	0	0	0	107.2	G559 F563	G559-H561 PolarHBondContact O-N 2.83Å; H561-F563 PolarHBondContact O-N 2.83Å
562	S	34.6	Very low	56	Low	104 Å²	104	105.9 Å²	105.9	73%	0.727	60%	0.6	S	S	*	*			trans	-60	123.1	-177.6	-52.7	0	0	0	0	111	D564	S562-D564 VanDerWaalsContact C-N 3.33Å; S562-D564 PolarHBondContact O-N 2.85Å; S562-D564 VanDerWaalsContact O-N 3.14Å
563	F	34.9	Very low	53.7	Low	208 Å²	208	108.4 Å²	108.4	91%	0.912	62%	0.62	S	S	*	*			trans	-75.4	90	158.4	-91.6	-92	0	0	0	108.1	H561	H561-F563 PolarHBondContact O-N 2.83Å
564	D	36.3	Very low	51.7	Low	146 Å²	146	113.2 Å²	113.2	78%	0.781	65%	0.645	S	S	*	*			trans	-152.7	134.9	160	-92.4	-46.2	0	0	0	110.1	S562	S562-D564 VanDerWaalsContact C-N 3.33Å; S562-D564 PolarHBondContact O-N 2.85Å; S562-D564 VanDerWaalsContact O-N 3.14Å
565	T	37.9	Very low	49.2	Very low	123 Å²	123	118.7 Å²	118.7	76%	0.755	68%	0.681	S	S	*	*			trans	58.9	97.1	167.5	-48.4	0	0	0	0	118.5	P567	T565-P567 WeakPolarHBondContact O-CD 3.28Å
566	E	32.1	Very low	46.8	Very low	182 Å²	182	121.4 Å²	121.4	85%	0.85	70%	0.698	S	S	*	*			trans	-51.3	122	146.9	-94.2	-88.2	135.4	0	0	110.9
567	P	37.9	Very low	44.5	Very low	112 Å²	112	127.2 Å²	127.2	73%	0.727	73%	0.725	S	S	*	*			trans	-90.2	101.2	169.8	33.3	-27.7	0	0	0	109.9	T565	T565-P567 WeakPolarHBondContact O-CD 3.28Å
568	A	37.2	Very low	42	Very low	91 Å²	91	134.6 Å²	134.6	75%	0.752	76%	0.758	S	S	*	*			trans	-58	143.1	171	0	0	0	0	0	111.1
569	A	39.3	Very low	40.5	Very low	89 Å²	89	133.3 Å²	133.3	74%	0.736	77%	0.769	S	S	*	*			trans	-57.4	148.2	171.1	0	0	0	0	0	110.1
570	T	42.1	Very low	39	Very low	122 Å²	122	136.3 Å²	136.3	75%	0.748	78%	0.778	S	S	*	*				-159.1	165.6	54.8	47.5	0	0	0	0	114.2
571	S	41.4	Very low	38.4	Very low	91 Å²	91	138.4 Å²	138.4	64%	0.636	78%	0.783	S	S	*	*			trans	59.1	115.5	151	58.8	0	0	0	0	120.5
572	N	37.9	Very low	37.9	Very low	143 Å²	143	137.5 Å²	137.5	77%	0.765	78%	0.784	S	S	*	*				43.1	126.6	122.2	-49.3	9.7	0	0	0	117.7
573	D	40.7	Very low	38.2	Very low	140 Å²	140	139.3 Å²	139.3	75%	0.749	79%	0.79	S	S	*	*			cis	-166.4	170.8	41.2	-100	-45.9	0	0	0	113.1
574	I	46.6	Very low	38.3	Very low	157 Å²	157	137.7 Å²	137.7	81%	0.805	79%	0.785	S	S	*	*			trans	74.1	127.8	164.7	-60	145	0	0	0	118.2
575	P	37.5	Very low	38.3	Very low	115 Å²	115	140 Å²	140	75%	0.747	79%	0.788	S	S	*	*			trans	-112	-168.2	-178.2	49.5	-40.5	0	0	0	112.3
576	P	37.6	Very low	38.4	Very low	125 Å²	125	140.1 Å²	140.1	81%	0.812	79%	0.791	S	S	*	*				-121.8	165.5	-120.1	27.5	-3.7	0	0	0	116.7
577	I	42.7	Very low	38.4	Very low	173 Å²	173	138.9 Å²	138.9	89%	0.887	79%	0.788	S	S	*	*			trans	-123	146.8	173.8	-63.5	-179.1	0	0	0	111.1
578	K	36.3	Very low	38.4	Very low	196 Å²	196	144 Å²	144	85%	0.852	79%	0.793	S	S	*	*			trans	-95.1	142.4	-173.8	-47	163.7	-174.9	170.4	0	111.8
579	S	40.4	Very low	38.4	Very low	103 Å²	103	150.5 Å²	150.5	72%	0.72	80%	0.798	S	S	*	*			trans	-177.5	149.3	133.8	52.5	0	0	0	0	111.9
580	C	30.1	Very low	38.1	Very low	124 Å²	124	155.2 Å²	155.2	84%	0.838	80%	0.804	S	S	*	*			trans	-99.5	139.1	176.7	-50.5	0	0	0	0	110.9
581	F	38.5	Very low	38.2	Very low	189 Å²	189	154.5 Å²	154.5	83%	0.829	81%	0.805	S	S	*	*			trans	-142.2	134.6	162.8	-82.1	-73.8	0	0	0	112
582	N	34.4	Very low	38	Very low	155 Å²	155	158.1 Å²	158.1	83%	0.829	81%	0.812	S	S	*	*			trans	-86.2	142.6	170.9	-70.1	-39	0	0	0	110.1
583	V	40.1	Very low	38	Very low	142 Å²	142	159.4 Å²	159.4	86%	0.861	82%	0.818	S	S	*	*			trans	-132.1	141.4	166.2	-175.8	0	0	0	0	109.3
584	H	37.8	Very low	37.8	Very low	174 Å²	174	161 Å²	161	81%	0.806	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-90.8	162.6	-169.6	-72.9	59.8	0	0	0	113.3
585	K	36	Very low	37.8	Very low	195 Å²	195	157.7 Å²	157.7	85%	0.848	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-73.1	142.5	170.7	-66.5	-179.5	178	179.7	0	111.9
586	P	40.1	Very low	37.9	Very low	125 Å²	125	157.8 Å²	157.8	81%	0.812	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-87.4	157.9	157.7	34.8	-32	0	0	0	112.4
587	I	32.1	Very low	37.9	Very low	155 Å²	155	157.5 Å²	157.5	80%	0.795	81%	0.81	S	S	*	*			trans	-137.3	160.3	174.6	-65.9	178.2	0	0	0	108.4
588	R	36.9	Very low	37.7	Very low	220 Å²	220	157.6 Å²	157.6	83%	0.83	81%	0.811	S	S	*	*			trans	101.5	148.1	176.1	-58.2	171.9	164.6	-179.7	-5.6	113.3
589	R	38	Very low	37.7	Very low	228 Å²	228	153.1 Å²	153.1	86%	0.86	80%	0.804	S	S	*	*			cis	-130.8	-178.5	12.1	-75.8	-173.8	168.2	121.8	-2	113.4
590	H	32.4	Very low	37.7	Very low	187 Å²	187	156.7 Å²	156.7	87%	0.866	81%	0.809	S	S	*	*			trans	-97.4	159.2	-175.3	-67.1	-133.4	0	0	0	114.7
591	S	45.6	Very low	38.1	Very low	108 Å²	108	157.3 Å²	157.3	76%	0.755	81%	0.809	S	S	*	*			trans	-176.3	104.8	140.3	-168.2	0	0	0	0	106.5
592	E	35.3	Very low	37.8	Very low	167 Å²	167	156.2 Å²	156.2	78%	0.78	81%	0.812	S	S	*	*				58.8	100.3	80.1	-66.5	-167.5	142.2	0	0	115.1
593	L	39.7	Very low	37.6	Very low	170 Å²	170	154.4 Å²	154.4	89%	0.89	81%	0.811	S	S	*	*				-166.3	152.1	128.2	-128.1	75.2	0	0	0	113
594	E	36.7	Very low	37.3	Very low	172 Å²	172	154.7 Å²	154.7	80%	0.804	81%	0.805	S	S	*	*			trans	-41.1	163.2	169.1	-73.8	-169.1	93.9	0	0	118.7
595	S	45.1	Very low	37.1	Very low	88 Å²	88	151 Å²	151	62%	0.615	80%	0.798	S	S	*	*			cis	-156.3	-154.8	-4.1	-95.3	0	0	0	0	110
596	P	39.2	Very low	36.9	Very low	117 Å²	117	149.1 Å²	149.1	76%	0.76	80%	0.798	S	S	*	*				-126.5	-144.1	-110.7	43.9	-19.9	0	0	0	113.9
597	P	38.4	Very low	36.4	Very low	119 Å²	119	151.2 Å²	151.2	77%	0.773	80%	0.795	S	S	*	*				-117.2	155.5	-125.1	32.4	-11.4	0	0	0	116.6
598	I	39.2	Very low	36.3	Very low	176 Å²	176	150.2 Å²	150.2	90%	0.903	79%	0.791	S	S	*	*			trans	-127	139.8	163.4	-63.2	-178.9	0	0	0	109.3
599	S	35.4	Very low	36.1	Very low	102 Å²	102	149.4 Å²	149.4	71%	0.713	79%	0.788	S	S	*	*			trans	-94.4	150.4	-174.7	53.4	0	0	0	0	112.8
600	Q	40.3	Very low	35.8	Very low	177 Å²	177	146 Å²	146	83%	0.827	78%	0.782	S	S	*	*				-174.1	135	125.1	-103.1	172.7	29.6	0	0	114.4
601	V	38.1	Very low	35.6	Very low	137 Å²	137	145.9 Å²	145.9	83%	0.83	77%	0.774	S	S	*	*			trans	52.4	134.7	160.2	-58.4	0	0	0	0	121.5
602	N	32.7	Very low	34.9	Very low	166 Å²	166	144.8 Å²	144.8	89%	0.888	77%	0.766	S	S	*	*			trans	-83.9	145.7	-175.8	-69.8	-36.6	0	0	0	113.8
603	S	29.9	Very low	34.8	Very low	117 Å²	117	148 Å²	148	82%	0.818	77%	0.773	S	S	*	*			trans	-86.2	136.7	165.8	-176.8	0	0	0	0	111.4
604	M	35.4	Very low	34.5	Very low	149 Å²	149	143.7 Å²	143.7	73%	0.734	77%	0.769	S	S	*	*			trans	-133.9	131.5	160.8	-72.7	-159.6	75.4	0	0	110.2	N606	M604-N606 PolarHBondContact O-N 2.9Å
605	S	32	Very low	34.4	Very low	95 Å²	95	139.9 Å²	139.9	66%	0.664	76%	0.762	S	S	*	*			trans	-85.2	89.2	-164.8	40.1	0	0	0	0	113.7	F607	S605-F607 PolarHBondContact O-N 3.25Å
606	N	32.8	Very low	34	Very low	157 Å²	157	143.1 Å²	143.1	84%	0.84	77%	0.772	S	S	*	*			trans	-69.2	87.9	171.8	-86.9	-32.5	0	0	0	112.4	M604 N608	M604-N606 PolarHBondContact O-N 2.9Å; N606-N608 PolarHBondContact O-N 3.13Å
607	F	30.2	Very low	34	Very low	169 Å²	169	142.7 Å²	142.7	74%	0.741	77%	0.772	S	S	*	*			trans	-73.4	53.6	170.1	-89.8	-71.1	0	0	0	113.1	S605 R609	S605-F607 PolarHBondContact O-N 3.25Å; F607-R609 PolarHBondContact O-N 3.1Å
608	N	28.3	Very low	33.7	Very low	134 Å²	134	141.6 Å²	141.6	72%	0.717	77%	0.767	S	S	*	*			trans	-85	94	176.1	-163	14.7	0	0	0	110.3	N606 Q610	N606-N608 PolarHBondContact O-N 3.13Å; N608-Q610 VanDerWaalsContact C-N 3.32Å; N608-Q610 PolarHBondContact O-N 3.08Å
609	R	32.9	Very low	33.5	Very low	202 Å²	202	140.8 Å²	140.8	76%	0.762	76%	0.761	S	S	*	*			trans	-84.2	73.3	-171.5	-145.3	177.8	-65.8	-103.4	3.4	111.6	F607	F607-R609 PolarHBondContact O-N 3.1Å
610	Q	32.5	Very low	33.3	Very low	157 Å²	157	144.3 Å²	144.3	73%	0.734	77%	0.766	S	S	*	*			trans	-68.8	142.1	-178.5	-166.3	166.6	-0.1	0	0	112.1	N608 S612	N608-Q610 VanDerWaalsContact C-N 3.32Å; N608-Q610 PolarHBondContact O-N 3.08Å; Q610-S612 PolarHBondContact O-N 2.92Å
611	W	28.6	Very low	33	Very low	184 Å²	184	139.7 Å²	139.7	70%	0.697	75%	0.754	S	S	*	*			trans	-91.3	82.4	-175.2	-71.3	50.1	0	0	0	111.6
612	S	29.9	Very low	32.7	Very low	86 Å²	86	139.3 Å²	139.3	60%	0.601	75%	0.754	S	S	*	*			trans	-143.2	117.8	173.8	-58.4	0	0	0	0	111.4	Q610	Q610-S612 PolarHBondContact O-N 2.92Å
613	Y	33	Very low	32.9	Very low	235 Å²	235	142.7 Å²	142.7	92%	0.922	75%	0.754	S	S	*	*			trans	-169.1	136.7	144.2	-103.4	-63.9	0	0	0	110.3
614	G	34.2	Very low	33	Very low	78 Å²	78	142.3 Å²	142.3	80%	0.804	75%	0.752	S	S	*	*			trans	161.3	50.2	-172.9	0	0	0	0	0	112.6
615	S	34.3	Very low	32.9	Very low	93 Å²	93	141.9 Å²	141.9	65%	0.65	75%	0.753	S	S	*	*			trans	-72.7	146.9	-168.6	-44.8	0	0	0	0	114.1
616	N	37.4	Very low	33.1	Very low	155 Å²	155	141.9 Å²	141.9	83%	0.829	75%	0.752	S	S	*	*			trans	-165.1	142.2	130.5	-108.8	-13.4	0	0	0	116
617	S	37.6	Very low	33.2	Very low	108 Å²	108	139.9 Å²	139.9	76%	0.755	75%	0.751	S	S	*	*			trans	46.1	101.5	153.6	59.2	0	0	0	0	121.3
618	S	32.2	Very low	33.5	Very low	97 Å²	97	139.7 Å²	139.7	68%	0.678	75%	0.754	S	S	*	*			trans	-47.3	149.2	152.7	167.3	0	0	0	0	115.5
619	M	35	Very low	33.9	Very low	159 Å²	159	140.6 Å²	140.6	78%	0.783	76%	0.757	S	S	*	*				-175.4	134.9	120.1	-82.7	-31.2	172.4	0	0	112.7
620	E	31.7	Very low	33.9	Very low	175 Å²	175	138.2 Å²	138.2	82%	0.818	76%	0.76	S	S	*	*			trans	59.2	157.8	152.7	-64.1	-170.1	104.5	0	0	119.5
621	S	34.7	Very low	34.1	Very low	80 Å²	80	136.8 Å²	136.8	56%	0.559	76%	0.762	S	S	*	*			cis	-161	147.8	-20.1	-104.1	0	0	0	0	108.3
622	P	31	Very low	34.3	Very low	130 Å²	130	131.2 Å²	131.2	84%	0.844	76%	0.762	S	S	*	*			trans	-77.1	133.5	176.1	31.5	-33.5	0	0	0	111.5
623	R	37.8	Very low	34.7	Very low	236 Å²	236	135.6 Å²	135.6	89%	0.891	78%	0.777	S	S	*	*			trans	-144.7	118	170.9	-73.3	-166.9	178	-178.2	0.9	112.6
624	S	32.1	Very low	34.9	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	77%	0.771	S	S	*	*			trans	-55.8	154	147.1	-41.5	0	0	0	0	108.9
625	D	33.4	Very low	35.4	Very low	141 Å²	141	132 Å²	132	75%	0.754	77%	0.768	S	S	*	*				-173.6	166.9	63.5	-145.9	-60.5	0	0	0	113
626	S	35.1	Very low	35.5	Very low	94 Å²	94	135.8 Å²	135.8	66%	0.657	78%	0.775	S	S	*	*			trans	76.4	136.7	144.1	-77.3	0	0	0	0	123.3
627	S	36.3	Very low	35.6	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	77%	0.77	S	S	*	*			trans	79.7	135.4	152.4	84.5	0	0	0	0	117.3
628	M	36.4	Very low	35.6	Very low	166 Å²	166	134.7 Å²	134.7	82%	0.818	77%	0.774	S	S	*	*			cis	-163.5	166	-9.9	-148.4	174	179.1	0	0	111.8
629	I	36.1	Very low	35.9	Very low	152 Å²	152	133.8 Å²	133.8	78%	0.779	78%	0.78	S	S	*	*			trans	43.2	123.9	162.1	43	165.7	0	0	0	120.8
630	D	33.6	Very low	36	Very low	152 Å²	152	133.4 Å²	133.4	81%	0.813	79%	0.787	S	S	*	*				-148.5	160.8	105.9	-152.2	-6.4	0	0	0	111.4
631	T	36.3	Very low	36.2	Very low	127 Å²	127	128.6 Å²	128.6	78%	0.779	78%	0.784	S	S	*	*			trans	-88.3	166.7	168.5	51.4	0	0	0	0	109.9
632	G	32.5	Very low	36.3	Very low	68 Å²	68	129.6 Å²	129.6	70%	0.701	79%	0.791	S	S	*	*			cis	157.9	142.1	-2.2	0	0	0	0	0	110.6
633	I	38.4	Very low	36.6	Very low	178 Å²	178	131.1 Å²	131.1	91%	0.913	79%	0.79	S	S	*	*			trans	-134.4	151	177.6	-64.8	-175.8	0	0	0	109.8
634	V	37.9	Very low	36.6	Very low	132 Å²	132	124 Å²	124	80%	0.8	78%	0.777	S	S	*	*			trans	-109.5	139.3	-159.6	-146.4	0	0	0	0	113.3
635	S	43.4	Very low	36.7	Very low	105 Å²	105	127.5 Å²	127.5	73%	0.734	78%	0.781	S	S	*	*			trans	-178.8	119.9	147.4	-85.5	0	0	0	0	106.6
636	E	37.2	Very low	36.7	Very low	173 Å²	173	124.7 Å²	124.7	81%	0.808	78%	0.778	S	S	*	*				61.5	125.1	80	-68.2	-160	160.7	0	0	114
637	V	38.5	Very low	36.7	Very low	120 Å²	120	125.9 Å²	125.9	73%	0.727	79%	0.786	S	S	*	*			cis	-154.6	153.4	-6	-95.3	0	0	0	0	111.5
638	S	38.5	Very low	36.8	Very low	120 Å²	120	126.1 Å²	126.1	84%	0.839	79%	0.788	S	S	*	*			trans	39	118.8	152.8	62.8	0	0	0	0	121.9
639	G	38.4	Very low	36.9	Very low	78 Å²	78	123 Å²	123	80%	0.804	78%	0.782	S	S	*	*			trans	-172.3	117.2	159	0	0	0	0	0	111.9
640	V	36.7	Very low	37	Very low	151 Å²	151	122.9 Å²	122.9	92%	0.915	78%	0.782	S	S	*	*			trans	-107.7	133.2	-171.1	-179.3	0	0	0	0	111.6
641	G	36.2	Very low	37.4	Very low	74 Å²	74	122.6 Å²	122.6	76%	0.763	78%	0.781	S	S	*	*			trans	-171.4	130.9	170.8	0	0	0	0	0	111.2
642	S	36.1	Very low	37.6	Very low	101 Å²	101	120.8 Å²	120.8	71%	0.706	77%	0.773	S	S	*	*			trans	-126.1	179	-167.2	-57.8	0	0	0	0	112.4
643	I	38.7	Very low	38	Very low	161 Å²	161	124.1 Å²	124.1	83%	0.826	77%	0.773	S	S	*	*			trans	80.9	138.9	161.1	-59.5	158.8	0	0	0	115
644	S	36.7	Very low	38	Very low	87 Å²	87	124.8 Å²	124.8	61%	0.608	77%	0.77	S	S	*	*			cis	-171	152.2	-21.8	-96.4	0	0	0	0	112.2
645	Q	35.4	Very low	38	Very low	183 Å²	183	126.4 Å²	126.4	86%	0.855	77%	0.769	S	S	*	*			trans	63.2	136.9	140.3	-68	179.2	17.8	0	0	124.9
646	A	31.5	Very low	37.6	Very low	82 Å²	82	128.7 Å²	128.7	68%	0.678	77%	0.765	S	S	*	*			trans	76.5	88.2	130.1	0	0	0	0	0	124
647	S	35.8	Very low	37.6	Very low	119 Å²	119	126.9 Å²	126.9	83%	0.832	76%	0.757	S	S	*	*				36.9	119.2	117.2	62.3	0	0	0	0	123.6
648	S	38.2	Very low	37.7	Very low	120 Å²	120	127.1 Å²	127.1	84%	0.839	75%	0.75	S	S	*	*			trans	-163.4	168.3	145.4	67.5	0	0	0	0	108.3
649	S	39.6	Very low	37.5	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	75%	0.745	S	S	*	*			cis	-154.7	137.8	-12.8	-111.4	0	0	0	0	106.7
650	L	38	Very low	37.8	Very low	150 Å²	150	131.7 Å²	131.7	79%	0.785	75%	0.745	S	S	*	*				66.9	142.7	82.3	-78.3	175.1	0	0	0	117.7
651	N	40.6	Very low	38	Very low	147 Å²	147	134 Å²	134	79%	0.786	74%	0.743	S	S	*	*			trans	84.5	143	174.1	-51.8	-36.7	0	0	0	117.2
652	S	40.9	Very low	38.2	Very low	89 Å²	89	135.9 Å²	135.9	62%	0.622	74%	0.74	S	S	*	*			cis	-164.6	130.9	-12.8	-108.2	0	0	0	0	116.7
653	I	40.6	Very low	38.4	Very low	138 Å²	138	137.1 Å²	137.1	71%	0.708	74%	0.743	S	S	*	*				54.9	110.7	122.7	-56.8	173	0	0	0	122.3
654	K	40	Very low	38.4	Very low	191 Å²	191	135 Å²	135	83%	0.83	74%	0.739	S	S	*	*			trans	169.6	126.3	131.1	-92.8	154.1	-171.3	177	0	108.7
655	Q	37.7	Very low	38.2	Very low	167 Å²	167	140.4 Å²	140.4	78%	0.78	75%	0.747	S	S	*	*				64.7	137.4	57.3	-64.1	-160.8	15	0	0	113.5
656	K	34.4	Very low	38.6	Very low	153 Å²	153	140.3 Å²	140.3	67%	0.665	75%	0.751	S	S	*	*			cis	-167.7	162.3	26.1	-144.3	-173.1	155	-151.4	0	112.8
657	Q	36.8	Very low	38.9	Very low	135 Å²	135	139.5 Å²	139.5	63%	0.631	74%	0.738	S	S	*	*			trans	66.6	155.4	155.6	-77.3	177.1	-83.9	0	0	119.4
658	E	40.7	Very low	39.3	Very low	125 Å²	125	140.1 Å²	140.1	58%	0.584	73%	0.73	S	S	*	*			cis	-174.9	174	-24.5	-120.3	-178.5	-39.5	0	0	108.4
659	K	35.3	Very low	39.3	Very low	171 Å²	171	139.5 Å²	139.5	74%	0.743	72%	0.724	S	S	*	*			cis	-161	150.2	-6.2	-149.2	170.2	-168.3	140.3	0	109.9
660	P	44.3	Very low	39.2	Very low	122 Å²	122	143.5 Å²	143.5	79%	0.792	73%	0.729	S	S	*	*			trans	-107.5	170.6	-173.5	40.2	-36.1	0	0	0	116.9
661	K	41.4	Very low	39.2	Very low	200 Å²	200	140.6 Å²	140.6	87%	0.87	73%	0.726	S	S	*	*			trans	-155.9	126.8	173.9	-102.4	173.2	-176.1	178.2	0	116.6
662	T	39.2	Very low	39.3	Very low	114 Å²	114	139.3 Å²	139.3	70%	0.699	73%	0.726	S	S	*	*			trans	46.2	115.3	139.1	55.7	0	0	0	0	122.1
663	T	40.1	Very low	39.2	Very low	127 Å²	127	142.5 Å²	142.5	78%	0.779	74%	0.736	S	S	*	*				73.5	152.8	66.9	63.1	0	0	0	0	116.1
664	P	39.3	Very low	39.3	Very low	115 Å²	115	144.3 Å²	144.3	75%	0.747	75%	0.746	S	S	*	*			cis	-142.4	147.9	12.5	40.9	-20.5	0	0	0	120.4
665	R	33.2	Very low	39	Very low	202 Å²	202	146.2 Å²	146.2	76%	0.762	75%	0.748	S	S	*	*				38.8	127.2	124.7	-171.8	-176.5	-178.6	-176.1	3.6	124.2	T667	R665-T667 WeakPolarHBondContact CG-OG1 3.19Å; R665-T667 PolarHBondContact NE-OG1 2.87Å
666	L	43.1	Very low	38.9	Very low	180 Å²	180	144.8 Å²	144.8	94%	0.942	75%	0.751	S	S	*	*			trans	-130.6	164.4	136.5	-88.5	176.4	0	0	0	110.5
667	T	38.5	Very low	39	Very low	66 Å²	66	141.4 Å²	141.4	41%	0.405	75%	0.751	S	S	.	*			trans	-148.3	118.5	-141.9	-41.3	0	0	0	0	118.6	R665	R665-T667 WeakPolarHBondContact CG-OG1 3.19Å; R665-T667 PolarHBondContact NE-OG1 2.87Å
668	I	42.7	Very low	39	Very low	131 Å²	131	140.2 Å²	140.2	67%	0.672	76%	0.758	S	S	*	*			trans	65.3	160.3	143.4	-74.6	172.6	0	0	0	116.8	K670	I668-K670 HydrophobicContact CG2-CG 4.46Å
669	P	39.6	Very low	39	Very low	108 Å²	108	145.6 Å²	145.6	70%	0.701	77%	0.773	S	S	*	*			cis	-110	149	9.9	8	18.1	0	0	0	116.1
670	K	36.2	Very low	39.2	Very low	183 Å²	183	142.4 Å²	142.4	80%	0.796	77%	0.772	S	S	*	*				56.5	140.2	82.5	-64.1	179.4	175.1	-179.5	0	113.3	I668	I668-K670 HydrophobicContact CG2-CG 4.46Å
671	A	38.7	Very low	39	Very low	89 Å²	89	147.8 Å²	147.8	74%	0.736	78%	0.776	S	S	*	*			cis	164.6	177.5	-0.9	0	0	0	0	0	104.6
672	P	42.9	Very low	38.8	Very low	120 Å²	120	145.1 Å²	145.1	78%	0.779	77%	0.772	S	S	*	*			cis	-130.2	171.9	7	42.1	-25.9	0	0	0	116.4
673	N	38	Very low	38.8	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	77%	0.77	S	S	*	*			trans	-87.4	153.5	160.8	-79.6	-82.8	0	0	0	110.4
674	L	42.8	Very low	39	Very low	175 Å²	175	143.3 Å²	143.3	92%	0.916	77%	0.769	S	S	*	*			trans	-134.7	114.8	153.1	-76.1	178.9	0	0	0	111.3
675	R	33.4	Very low	39.1	Very low	231 Å²	231	146.9 Å²	146.9	87%	0.872	77%	0.773	S	S	*	*			trans	-93.2	155.4	152.2	-70.7	175.8	170.4	168.5	-4.5	107.7
676	T	35.8	Very low	39.5	Very low	137 Å²	137	146.4 Å²	146.4	84%	0.84	78%	0.776	S	S	*	*				157.3	142	119.5	-64.5	0	0	0	0	112.7
677	A	38.3	Very low	39.4	Very low	82 Å²	82	145 Å²	145	68%	0.678	77%	0.77	S	S	*	*			trans	2.8	121.8	168.2	0	0	0	0	0	122
678	S	36	Very low	40.2	Very low	110 Å²	110	147 Å²	147	77%	0.769	78%	0.784	S	S	*	*				26.2	112.6	113	-45.3	0	0	0	0	120.2
679	R	40	Very low	40.3	Very low	239 Å²	239	147.7 Å²	147.7	90%	0.902	79%	0.789	S	S	*	*				166.9	131.4	111.3	-91.7	173.1	174.8	-176.1	-1.3	115
680	S	40.3	Very low	40.6	Very low	103 Å²	103	147.8 Å²	147.8	72%	0.72	79%	0.792	S	S	*	*			trans	49.4	120.9	145.3	61.8	0	0	0	0	124.1
681	R	38.9	Very low	41.1	Very low	235 Å²	235	142 Å²	142	89%	0.887	78%	0.784	S	S	*	*			trans	71.9	102.1	132.6	-70.1	-176.4	178.1	162.5	-0.4	122.6
682	D	37.5	Very low	41.6	Very low	145 Å²	145	147.3 Å²	147.3	78%	0.775	79%	0.791	S	S	*	*				82	139	103.9	-137.8	-33.9	0	0	0	123
683	S	40.6	Very low	41.7	Very low	95 Å²	95	148 Å²	148	66%	0.664	79%	0.788	S	S	*	*			trans	101.4	123.9	140.9	-81.6	0	0	0	0	124.3
684	S	43.8	Very low	42	Very low	108 Å²	108	146.8 Å²	146.8	76%	0.755	78%	0.78	S	S	*	*			trans	73.9	154	164.7	84.2	0	0	0	0	116.9
685	K	41.7	Very low	42.3	Very low	189 Å²	189	142.7 Å²	142.7	82%	0.822	77%	0.766	S	S	*	*			cis	-164	144.1	12.2	-134.1	156.4	-172	168.9	0	105.8
686	K	41.6	Very low	42.6	Very low	192 Å²	192	138.7 Å²	138.7	84%	0.835	76%	0.762	S	S	*	*				-168.4	144.1	51.7	-74.7	173.9	173.5	174.7	0	112.5
687	N	39.5	Very low	43	Very low	152 Å²	152	138.3 Å²	138.3	81%	0.813	76%	0.759	S	S	*	*			trans	-8.8	169.6	135	-82.8	34.5	0	0	0	122
688	P	56.4	Low	43.1	Very low	106 Å²	106	138.5 Å²	138.5	69%	0.688	76%	0.761	S	S	*	*			cis	-126.7	-155	-11.1	40.9	-22.9	0	0	0	110.5
689	D	43.8	Very low	43.3	Very low	147 Å²	147	139.7 Å²	139.7	79%	0.786	76%	0.764	S	S	*	*			cis	-158.8	175.1	-13.3	-128.9	-42.2	0	0	0	105.9
690	S	46.4	Very low	43.3	Very low	109 Å²	109	132.4 Å²	132.4	76%	0.762	75%	0.754	S	S	*	*			cis	-156.4	-179.2	-4.2	65	0	0	0	0	106.5
691	G	46.8	Very low	43.3	Very low	62 Å²	62	130.9 Å²	130.9	64%	0.639	75%	0.748	S	S	*	*			cis	153.6	148.9	-1.6	0	0	0	0	0	110.7
692	K	48.7	Very low	43.4	Very low	201 Å²	201	123.8 Å²	123.8	87%	0.874	74%	0.735	S	S	*	*			trans	71.1	138	-173	-56.6	178.7	-179	175.7	0	113.8
693	N	44.8	Very low	43.5	Very low	134 Å²	134	126.4 Å²	126.4	72%	0.717	74%	0.735	S	S	*	*			cis	-163	163.4	3.9	-110.2	16.2	0	0	0	108.3
694	I	45.5	Very low	43.4	Very low	131 Å²	131	127.1 Å²	127.1	67%	0.672	74%	0.74	S	S	*	*			cis	-168	150	-16.1	-163.9	172.5	0	0	0	110.1
695	S	47.7	Very low	43.2	Very low	89 Å²	89	133.5 Å²	133.5	62%	0.622	75%	0.747	S	S	*	*			trans	49.6	149.6	155.5	67.4	0	0	0	0	124.2
696	D	41.5	Very low	43.1	Very low	147 Å²	147	128.7 Å²	128.7	79%	0.786	74%	0.743	S	S	*	*			cis	-175	-179.5	-24.3	-99.3	-46.9	0	0	0	110.8
697	V	44.1	Very low	42.9	Very low	129 Å²	129	125 Å²	125	78%	0.782	74%	0.741	S	S	*	*			trans	76.5	103.1	165.8	-165.3	0	0	0	0	115.1
698	A	40.5	Very low	43	Very low	86 Å²	86	123.3 Å²	123.3	71%	0.711	74%	0.741	S	S	*	*				78.9	146.1	55.4	0	0	0	0	0	113.4
699	T	39.8	Very low	42	Very low	134 Å²	134	122.9 Å²	122.9	82%	0.822	75%	0.747	S	S	*	*			cis	-148.4	170.5	31.2	-64.3	0	0	0	0	112.8
700	A	40.3	Very low	41.8	Very low	86 Å²	86	126 Å²	126	71%	0.711	75%	0.754	S	S	*	*			trans	-62.3	-174.8	173.3	0	0	0	0	0	114.2
701	A	39.8	Very low	41.3	Very low	72 Å²	72	131.6 Å²	131.6	60%	0.595	76%	0.758	S	S	*	*			cis	-167.5	179.4	16.5	0	0	0	0	0	109.8	Y703	A701-Y703 HydrophobicContact CB-CE2 4.31Å
702	S	40.1	Very low	41	Very low	85 Å²	85	135.1 Å²	135.1	59%	0.594	77%	0.767	S	S	*	*			cis	178.1	-177.3	-30.6	-90.6	0	0	0	0	110.7
703	Y	40.1	Very low	40.5	Very low	201 Å²	201	132.2 Å²	132.2	79%	0.788	76%	0.761	S	S	*	*			trans	73.5	139.1	156.9	-14.7	-87.3	0	0	0	123	A701	A701-Y703 HydrophobicContact CB-CE2 4.31Å
704	S	38.5	Very low	40.4	Very low	109 Å²	109	132.2 Å²	132.2	76%	0.762	77%	0.766	S	S	*	*			trans	77.4	97.1	136.7	-63.1	0	0	0	0	124.1
705	R	39.7	Very low	40.1	Very low	242 Å²	242	131.5 Å²	131.5	91%	0.913	77%	0.77	S	S	*	*				47.3	121.1	116.2	-76	-176.8	170.7	179.9	-2.8	122
706	A	38.6	Very low	39.6	Very low	88 Å²	88	133.9 Å²	133.9	73%	0.727	78%	0.78	S	S	*	*				94.3	129.6	121.6	0	0	0	0	0	122.6
707	S	38.3	Very low	39.7	Very low	115 Å²	115	130.2 Å²	130.2	80%	0.804	78%	0.778	S	S	*	*			trans	80.2	149.8	145.3	-61.6	0	0	0	0	121.9
708	S	41.4	Very low	39.5	Very low	116 Å²	116	131.3 Å²	131.3	81%	0.811	78%	0.779	S	S	*	*			trans	72.3	91.8	158.3	-60.9	0	0	0	0	120.2
709	A	36.4	Very low	39.3	Very low	98 Å²	98	135.7 Å²	135.7	81%	0.81	78%	0.782	S	S	*	*			trans	33.7	118.7	131.4	0	0	0	0	0	120.8
710	K	39.1	Very low	39.3	Very low	213 Å²	213	140.9 Å²	140.9	93%	0.926	79%	0.786	S	S	*	*			trans	-156.7	153.5	135.6	-114.7	156.8	-172.3	170.7	0	113
711	R	35.4	Very low	39.2	Very low	225 Å²	225	143.2 Å²	143.2	85%	0.849	79%	0.787	S	S	*	*			trans	-68.3	152.2	172.9	-66.6	171.8	165.7	-174.9	-6.3	111.1
712	T	40.6	Very low	39.2	Very low	136 Å²	136	149.1 Å²	149.1	83%	0.834	80%	0.799	S	S	*	*			trans	-113.3	108.7	161.5	39.5	0	0	0	0	110.4
713	N	39	Very low	39.1	Very low	141 Å²	141	156.1 Å²	156.1	75%	0.754	81%	0.813	S	S	*	*			trans	-95.8	134.2	167.6	-87.9	10.3	0	0	0	109.2
714	V	42.5	Very low	39.2	Very low	134 Å²	134	152.4 Å²	152.4	81%	0.812	81%	0.811	S	S	*	*			trans	-148.8	127.6	176.3	-175.4	0	0	0	0	108.6
715	P	38.1	Very low	39.3	Very low	115 Å²	115	153.5 Å²	153.5	75%	0.747	82%	0.816	S	S	*	*				-121.8	150.1	-57.1	34.8	-19.2	0	0	0	111.7
716	V	38.5	Very low	39.2	Very low	139 Å²	139	146.6 Å²	146.6	84%	0.842	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-89.1	119.4	172.6	175.7	0	0	0	0	110
717	G	42.6	Very low	39.2	Very low	71 Å²	71	149.8 Å²	149.8	73%	0.732	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.9	141.9	171.9	0	0	0	0	0	112.1
718	N	40.2	Very low	39.3	Very low	151 Å²	151	149.7 Å²	149.7	81%	0.807	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-83.9	142.1	-173.5	-90.4	-51.6	0	0	0	114.2
719	K	36.4	Very low	39.1	Very low	178 Å²	178	153.8 Å²	153.8	77%	0.774	80%	0.799	S	S	*	*			trans	-3.6	136.2	149.9	-53.8	175.9	179.8	-177.6	0	117.4
720	R	40.2	Very low	39	Very low	243 Å²	243	155.2 Å²	155.2	92%	0.917	79%	0.793	S	S	*	*				-164	150.2	110.9	-99.4	154.4	-163.1	-179.4	5.8	111.6
721	D	37.2	Very low	38.8	Very low	135 Å²	135	152.7 Å²	152.7	72%	0.722	79%	0.789	S	S	*	*			trans	-78.6	164.4	-176.9	-42.7	-102.2	0	0	0	112
722	F	40.8	Very low	38.8	Very low	196 Å²	196	148 Å²	148	86%	0.86	79%	0.79	S	S	*	*				-178.6	121.4	120.3	-94.5	-59.6	0	0	0	114.7
723	R	37.4	Very low	38.5	Very low	232 Å²	232	146.4 Å²	146.4	88%	0.875	79%	0.785	S	S	*	*			trans	50.5	122.8	148	-77.9	-179.2	174.6	-165.5	-2.8	123.5
724	T	42.1	Very low	38.4	Very low	124 Å²	124	149 Å²	149	76%	0.761	79%	0.789	S	S	*	*			trans	-53.4	166.3	153.1	-8.7	0	0	0	0	114.6
725	P	40.7	Very low	38	Very low	132 Å²	132	153 Å²	153	86%	0.857	79%	0.79	S	S	*	*				-136.9	174.4	99.3	38	-26.1	0	0	0	115.6
726	S	36.8	Very low	38.1	Very low	96 Å²	96	156.5 Å²	156.5	67%	0.671	80%	0.796	S	S	*	*			trans	-118.8	150.8	-154.3	54	0	0	0	0	116.3
727	Q	40.4	Very low	38	Very low	156 Å²	156	156 Å²	156	73%	0.729	79%	0.789	S	S	*	*			trans	66.4	171	146.4	-72.9	-84.1	-33.4	0	0	116.2
728	P	40.2	Very low	37.9	Very low	113 Å²	113	158.8 Å²	158.8	73%	0.734	80%	0.797	S	S	*	*			cis	-137	164.4	12.5	43	-25	0	0	0	120.1
729	R	36.5	Very low	37.8	Very low	201 Å²	201	157.7 Å²	157.7	76%	0.758	80%	0.796	S	S	*	*			trans	15.7	132.8	145.6	-86.5	-179.5	-97	-168.8	-8	124
730	N	34.6	Very low	38	Very low	129 Å²	129	154.8 Å²	154.8	69%	0.69	80%	0.798	S	S	*	*				78.7	135.1	125.8	-70.9	4.8	0	0	0	124.5
731	L	34	Very low	37.8	Very low	159 Å²	159	154 Å²	154	83%	0.832	80%	0.795	S	S	*	*			trans	37.4	120	145.9	-72.7	87.2	0	0	0	120.9
732	S	37	Very low	37.9	Very low	126 Å²	126	151.8 Å²	151.8	88%	0.881	80%	0.795	S	S	*	*				-162.2	169	126	-163.4	0	0	0	0	111.4
733	S	33.6	Very low	37.9	Very low	103 Å²	103	147.2 Å²	147.2	72%	0.72	79%	0.788	S	S	*	*			trans	-120.4	145	-179.6	60.2	0	0	0	0	113.2
734	K	37.1	Very low	37.7	Very low	197 Å²	197	143.4 Å²	143.4	86%	0.857	79%	0.785	S	S	*	*			trans	178.1	132.6	160	-97.8	159.2	-177.6	-172.3	0	105.5
735	R	33.3	Very low	37.5	Very low	216 Å²	216	145.4 Å²	145.4	82%	0.815	79%	0.789	S	S	*	*			cis	70.4	88.8	22.2	-156.2	-176.7	-165.4	158.2	7.5	113.9
736	E	40.4	Very low	37.2	Very low	189 Å²	189	150.2 Å²	150.2	88%	0.883	79%	0.79	S	S	*	*			trans	-133.9	148.9	154.4	-67	-165.9	138.3	0	0	108.4
737	D	35.5	Very low	37.3	Very low	128 Å²	128	154.8 Å²	154.8	68%	0.684	80%	0.798	S	S	*	*			trans	-103.7	162.2	-168.3	-58.6	-83.7	0	0	0	112.3
738	S	41	Very low	37.2	Very low	130 Å²	130	153 Å²	153	91%	0.909	80%	0.797	S	S	*	*			trans	-150.5	128	161.6	-81.9	0	0	0	0	110.8
739	V	37.8	Very low	37	Very low	128 Å²	128	152.4 Å²	152.4	78%	0.776	80%	0.796	S	S	*	*			trans	-107.4	131.2	-162	173	0	0	0	0	111.7
740	S	40.6	Very low	37.1	Very low	117 Å²	117	149.5 Å²	149.5	82%	0.818	80%	0.795	S	S	*	*			trans	-179.6	157.5	138.8	-83.7	0	0	0	0	111.4
741	R	36	Very low	37.3	Very low	227 Å²	227	148.3 Å²	148.3	86%	0.857	80%	0.797	S	S	*	*			cis	173.2	150.3	-37.6	170.4	167.6	178.4	159.6	-0.7	105.2
742	A	39.1	Very low	37.7	Very low	88 Å²	88	150.6 Å²	150.6	73%	0.727	79%	0.794	S	S	*	*			trans	70.7	150.8	-179.8	0	0	0	0	0	115.6
743	S	41.4	Very low	37.8	Very low	101 Å²	101	151.6 Å²	151.6	71%	0.706	79%	0.785	S	S	*	*			cis	169.1	132.2	-47.4	48.4	0	0	0	0	108.1
744	N	33.9	Very low	38.1	Very low	152 Å²	152	151.7 Å²	151.7	81%	0.813	79%	0.786	S	S	*	*			trans	17.4	135.7	151.1	-56.8	-24.6	0	0	0	120.3
745	I	37.6	Very low	38.2	Very low	165 Å²	165	146.9 Å²	146.9	85%	0.846	78%	0.777	S	S	*	*				-163.6	146	113.2	-100.3	151.6	0	0	0	110.7
746	R	34.8	Very low	38.7	Very low	234 Å²	234	142.6 Å²	142.6	88%	0.883	78%	0.775	S	S	*	*			trans	-102.4	144.7	174.4	-59.6	172.8	179	162.5	-3.4	110.6
747	K	38.9	Very low	38.6	Very low	192 Å²	192	142.7 Å²	142.7	84%	0.835	77%	0.773	S	S	*	*			trans	-141.7	125.6	144.6	-66.1	-166.5	178	-176.8	0	107
748	V	38.5	Very low	38.5	Very low	118 Å²	118	147 Å²	147	72%	0.715	78%	0.78	S	S	*	*				69.7	98.9	56.4	180	0	0	0	0	108.8
749	S	36	Very low	38.4	Very low	101 Å²	101	150.3 Å²	150.3	71%	0.706	78%	0.78	S	S	*	*				72.8	151.2	89.9	-52.2	0	0	0	0	112.8
750	D	37.2	Very low	38.2	Very low	139 Å²	139	152 Å²	152	74%	0.743	78%	0.78	S	S	*	*			cis	-162.3	152.1	6.8	-131.6	-41.3	0	0	0	110.9
751	S	39.1	Very low	38.1	Very low	104 Å²	104	151.6 Å²	151.6	73%	0.727	78%	0.777	S	S	*	*			trans	163.6	118.7	158.8	56.6	0	0	0	0	109.4
752	R	41.9	Very low	38.1	Very low	207 Å²	207	146.6 Å²	146.6	78%	0.781	77%	0.772	S	S	*	*				65.6	141.3	55.1	-58.2	-164.8	179.3	-164.9	2.2	113.1
753	E	39.7	Very low	37.8	Very low	147 Å²	147	150.1 Å²	150.1	69%	0.687	78%	0.778	S	S	*	*			cis	-161	147.6	23.1	-148.2	149.2	-129.3	0	0	114.5
754	S	39.9	Very low	37.6	Very low	106 Å²	106	152.1 Å²	152.1	74%	0.741	79%	0.786	S	S	*	*			trans	64.6	157.2	149.2	76.6	0	0	0	0	120.6
755	S	40.5	Very low	37.5	Very low	96 Å²	96	152.7 Å²	152.7	67%	0.671	79%	0.789	S	S	*	*			cis	-167.1	152.5	-13	-113.1	0	0	0	0	112.8
756	T	42.1	Very low	37.2	Very low	126 Å²	126	151 Å²	151	77%	0.773	79%	0.79	S	S	*	*			trans	58.2	147.2	151.6	53.8	0	0	0	0	120.2
757	K	39.1	Very low	37.1	Very low	191 Å²	191	152 Å²	152	83%	0.83	79%	0.794	S	S	*	*			cis	-141.1	135.3	-7.4	-95.3	152.2	178.9	-177.3	0	104.3
758	R	34	Very low	36.9	Very low	219 Å²	219	147.5 Å²	147.5	83%	0.826	79%	0.793	S	S	*	*				54	99.7	70	-163.9	-177.5	-165	-170.4	5.1	115.1
759	E	37.5	Very low	36.6	Very low	198 Å²	198	149 Å²	149	93%	0.925	80%	0.797	S	S	*	*			trans	-149.7	152.2	132.8	-130.8	157.7	-130.2	0	0	109.6
760	E	34.8	Very low	36.5	Very low	165 Å²	165	150.2 Å²	150.2	77%	0.771	81%	0.805	S	S	*	*			trans	-153.3	119.7	-163.6	177.5	-175	-176.2	0	0	110.1
761	S	37.2	Very low	36.4	Very low	108 Å²	108	149.8 Å²	149.8	76%	0.755	81%	0.808	S	S	*	*			trans	-151	90.9	177.5	62.4	0	0	0	0	113.4
762	T	37.6	Very low	36.2	Very low	121 Å²	121	150.9 Å²	150.9	74%	0.742	81%	0.81	S	S	*	*			trans	31.9	116.9	136.2	57.6	0	0	0	0	120.6
763	L	32.8	Very low	36	Very low	162 Å²	162	151 Å²	151	85%	0.848	81%	0.811	S	S	*	*				43.1	115	125.2	-67.7	158.4	0	0	0	119.4
764	T	36.2	Very low	35.6	Very low	144 Å²	144	155.7 Å²	155.7	88%	0.883	82%	0.822	S	S	*	*				-161.7	147.9	120.7	7.7	0	0	0	0	111.9
765	N	32.8	Very low	35.5	Very low	163 Å²	163	155 Å²	155	87%	0.872	81%	0.814	S	S	*	*			trans	-91.8	125.8	171.1	-82.3	-41.9	0	0	0	110
766	C	31.3	Very low	35.2	Very low	130 Å²	130	158.2 Å²	158.2	88%	0.878	82%	0.823	S	S	*	*			trans	-137	132.2	157.6	-82.8	0	0	0	0	110.1
767	R	31.3	Very low	34.9	Very low	255 Å²	255	163 Å²	163	96%	0.962	83%	0.827	S	S	*	*			trans	-87.1	140.2	166	-69.3	177.3	170.1	121.3	-8.5	108.9
768	A	35.4	Very low	34.7	Very low	98 Å²	98	163.7 Å²	163.7	81%	0.81	82%	0.824	S	S	*	*			trans	-155.8	138.1	154.6	0	0	0	0	0	109.4
769	D	31.3	Very low	34.7	Very low	150 Å²	150	164 Å²	164	80%	0.802	84%	0.842	S	S	*	*			trans	-75.8	159.8	173.6	-67.2	-81.4	0	0	0	112.1
770	S	35.4	Very low	34.5	Very low	126 Å²	126	162.3 Å²	162.3	88%	0.881	84%	0.838	S	S	*	*			trans	-152.3	78	159.2	-80.4	0	0	0	0	110.7
771	T	33.8	Very low	34.5	Very low	130 Å²	130	162.2 Å²	162.2	80%	0.798	84%	0.841	S	S	*	*			trans	-66.4	123.8	169.1	7.2	0	0	0	0	110.9
772	T	35.9	Very low	34.4	Very low	127 Å²	127	165.2 Å²	165.2	78%	0.779	85%	0.846	S	S	*	*			trans	176	162.3	146.5	25.2	0	0	0	0	108.6
773	R	37.3	Very low	34.2	Very low	209 Å²	209	167.8 Å²	167.8	79%	0.789	85%	0.852	S	S	*	*			cis	-144.2	136.8	5.3	-133.4	167.3	-139.6	-133.3	2.8	108.7	T775	R773-T775 HydrophobicContact CG-CG2 4.17Å
774	R	31.6	Very low	34.3	Very low	245 Å²	245	168.1 Å²	168.1	93%	0.925	85%	0.853	S	S	*	*			trans	-113.6	93.1	164.5	-177.3	-170.6	-75.2	-174.9	-1.7	108.5
775	T	38.6	Very low	34.2	Very low	93 Å²	93	169.7 Å²	169.7	57%	0.571	85%	0.851	S	S	*	*			trans	-101.9	107.4	176.2	40.4	0	0	0	0	110.8	R773	R773-T775 HydrophobicContact CG-CG2 4.17Å
776	L	34	Very low	34.3	Very low	163 Å²	163	170.2 Å²	170.2	85%	0.853	85%	0.849	S	S	*	*			trans	-65.2	137.3	158.3	-75.3	157.4	0	0	0	108.9
777	W	34.8	Very low	34.5	Very low	227 Å²	227	173.3 Å²	173.3	86%	0.86	85%	0.847	S	S	*	*			trans	-128.2	122.5	156.3	-86.4	76.5	0	0	0	108
778	R	35.1	Very low	34.7	Very low	204 Å²	204	166.5 Å²	166.5	77%	0.77	84%	0.837	S	S	*	*			trans	-100.9	135.9	157.9	-84.7	-171.4	173.5	-155.3	0.7	107.1
779	N	33.7	Very low	34.7	Very low	226 Å²	226	172.7 Å²	172.7	100%	1.209	84%	0.84	S	S	*	*				-106	0	127.6	-75.4	-22	0	0	0	106.3

Retrieved 779 of 779 residues in 117.4 ms (Link to these results)

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